Ligand ID: EMH


Drugbank ID:
DB11363
(Alectinib)



Indication:
Alectinib is a kinase inhibitor indicated for the treatment of patients with anaplastic lymphoma kinase (ALK)-positive, metastatic non-small cell lung cancer (NSCLC) who have progressed on or are intolerant to crizotinib. This indication is approved under accelerated approval based on tumor response rate and duration of response. Continued approval for this indication may be contingent upon verification and description of clinical benefit in confirmatory trials.


Get human targets for EMH in PDB (known and potential targets)

RESULTS FROM SUB-STRUCTURAL SIMILARITY SEARCHES MAPPED TO LIGAND 'EMH' AND SARS-COV-2 / COVID-19 STRUCTURES

1) User may click on the DrReposER ID (the first column) to get information on the binding sites and drug molecule.
2) Click View (the second last column) to view matched residues and superposition in the NGL viewer (upper right part).
3) User may also click on the Dock (the last column) to get script for molecular docking in UCSF Chimera throuh AutoDock Vina.


DrReposER ID / Desc. Hit
PDBID
Hit
Macromolecule
Res.
Matches
View Interface RMSD Seq.
Identity (%)
HETATM Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
5rfc 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 10
LEU A 177
VAL A  20
LEU A  89
LEU A  30
GLY A 146
1.62A19.52
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
5rfc 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 12
GLY A 138
PHE A 185
GLY A 170
LEU A 141
ALA A 194
1.57A17.31
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
5rfc 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 12
GLY A  29
VAL A  18
ALA A  70
VAL A  77
ALA A  94
1.55A17.31
None
None
DMS  A 403 ( 4.2A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
5rfc 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 10
ALA A 211
VAL A 204
LEU A 208
LEU A 282
LEU A 287
1.74A19.52
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
5rfc 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 12
GLY A 138
ALA A 173
PHE A 185
GLY A 170
ALA A 194
1.68A17.31
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6lze VIRAL PROTEASE
(SARS-CoV-2)
5 / 10
LEU A 177
VAL A  20
LEU A  89
LEU A  30
GLY A 146
1.69A21.68
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6lze VIRAL PROTEASE
(SARS-CoV-2)
5 / 12
GLY A 138
PHE A 185
GLY A 170
LEU A 141
ALA A 194
1.56A22.45
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6lze VIRAL PROTEASE
(SARS-CoV-2)
5 / 12
GLY A  29
VAL A  18
ALA A  70
VAL A  77
ALA A  94
1.55A22.45
None
DMS  A 403 ( 4.9A)
DMS  A 403 ( 3.7A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6m0j SPIKE RECEPTOR
BINDING DOMAIN
(SARS-CoV-2)
5 / 12
LEU E 368
VAL E 367
GLY E 339
VAL E 341
LEU E 513
1.28A19.27
None
None
NAG  E 601 (-3.6A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6m0k VIRAL PROTEASE
(SARS-CoV-2)
5 / 10
LEU A 177
VAL A  20
LEU A  89
LEU A  30
GLY A 146
1.69A21.68
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6m0k VIRAL PROTEASE
(SARS-CoV-2)
5 / 12
GLY A 138
PHE A 185
GLY A 170
LEU A 141
ALA A 194
1.53A22.40
None
None
None
DMS  A 403 ( 4.8A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6m0k VIRAL PROTEASE
(SARS-CoV-2)
5 / 12
LEU A 167
GLY A 170
VAL A 171
ALA A 173
GLY A 195
1.63A22.40
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6m2n 3CL PROTEASE
(SARS-CoV-2)
5 / 12
LEU D 167
GLY D 170
VAL D 171
ALA D 173
GLY D 195
1.63A21.88
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6m2n 3CL PROTEASE
(SARS-CoV-2)
5 / 12
GLY D 138
PHE D 185
GLY D 170
LEU D 141
ALA D 194
1.55A21.88
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6m2n 3CL PROTEASE
(SARS-CoV-2)
5 / 10
VAL A  20
LEU A  89
LEU A  30
GLY A 146
LEU A  27
1.53A21.68
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6m2n 3CL PROTEASE
(SARS-CoV-2)
5 / 12
GLY D  29
VAL D  18
ALA D  70
VAL D  77
ALA D  94
1.57A21.88
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6m2n 3CL PROTEASE
(SARS-CoV-2)
5 / 12
GLY B  29
VAL B  18
ALA B  70
VAL B  77
ALA B  94
1.51A21.88
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6m2n 3CL PROTEASE
(SARS-CoV-2)
5 / 12
GLY C 138
PHE C 185
GLY C 170
LEU C 141
ALA C 194
1.51A21.88
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6m2n 3CL PROTEASE
(SARS-CoV-2)
5 / 10
LEU A 177
VAL A  20
LEU A  89
LEU A  30
GLY A 146
1.70A21.68
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6m2q 3CL PROTEASE
(SARS-CoV-2)
5 / 12
GLY A  29
VAL A  18
ALA A  70
VAL A  77
ALA A  94
1.58A21.88
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6m2q 3CL PROTEASE
(SARS-CoV-2)
5 / 10
LEU A 177
VAL A  20
LEU A  89
LEU A  30
GLY A 146
1.65A21.68
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6m71 NSP12
(SARS-CoV-2)
5 / 12
ARG A 132
ALA A  34
GLY A  44
TYR A 732
LEU A 240
1.52A18.04
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6m71 NSP12
(SARS-CoV-2)
5 / 10
ALA A 866
VAL A 880
LEU A 869
GLY A 839
LEU A 838
1.78A16.43
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6m71 NSP12
(SARS-CoV-2)
5 / 12
GLY A 203
VAL A 204
GLY A 220
HIS A  82
LEU A  90
1.29A18.04
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6m71 NSP12
(SARS-CoV-2)
5 / 12
LEU A 329
GLY A 345
VAL A 330
GLY A 327
ALA A 382
1.56A18.04
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6m71 NSP12
(SARS-CoV-2)
5 / 12
VAL A 342
ALA A 379
GLY A 345
HIS A 355
TYR A 273
1.33A18.04
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6m71 NSP12
(SARS-CoV-2)
5 / 10
ALA A 866
VAL A 880
LEU A 869
GLY A 841
LEU A 838
1.59A16.43
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6m71 NSP12
(SARS-CoV-2)
5 / 10
ARG A 631
LEU A 663
ALA A 660
VAL A 354
LEU A 351
1.76A16.43
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6m71 NSP7
NSP8
(SARS-CoV-2)
4 / 4
VAL C  53
LEU D 103
LEU D  98
ASP C   5
1.73A12.50
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6m71 NSP12
(SARS-CoV-2)
5 / 12
GLY A 345
VAL A 535
ALA A 656
GLY A 352
HIS A 347
1.35A18.04
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6m71 NSP12
(SARS-CoV-2)
5 / 10
LEU A 663
VAL A 637
LEU A 638
MET A 633
LEU A 636
1.76A16.43
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6vsb SPIKE GLYCOPROTEIN
(SARS-CoV-2)
4 / 4
VAL A 534
LEU A 552
LEU A 585
ASP A 578
1.61A14.44
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6vsb SPIKE GLYCOPROTEIN
(SARS-CoV-2)
5 / 12
LEU A1034
VAL C1040
ALA A 890
GLY A 885
LEU A 877
1.30A14.44
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6vww URIDYLATE-SPECIFIC
ENDORIBONUCLEASE
(SARS-CoV-2)
5 / 12
LEU B 201
ALA B 256
VAL B 295
TYR B 279
LEU B 266
1.29A21.94
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6vxs NSP3
(SARS-CoV-2)
5 / 10
LEU B  75
ALA B  39
VAL B  36
LEU B  43
LEU B  93
1.71A
SO4  B 201 ( 4.4A)
None
None
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6vxs NSP3
(SARS-CoV-2)
5 / 12
LEU B 126
ALA B 129
PHE B 132
VAL B 142
LEU B 140
1.62A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6vxs NSP3
(SARS-CoV-2)
4 / 4
VAL A 165
LEU A 164
LEU A 160
ASP A 135
1.51A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6vxs NSP3
(SARS-CoV-2)
5 / 10
LEU B 127
ALA B 124
VAL B  34
LEU B 122
LEU B  93
1.47A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6vxs NSP3
(SARS-CoV-2)
5 / 10
LEU B 140
VAL B  36
LEU B 122
LEU B 153
LEU B 127
1.76A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6vxs NSP3
(SARS-CoV-2)
5 / 10
LEU A  75
ALA A  39
VAL A  36
LEU A  43
LEU A  93
1.72A
SO4  A 201 (-4.1A)
None
None
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6vxs NSP3
(SARS-CoV-2)
5 / 10
LEU A 127
ALA A 124
VAL A  34
LEU A 122
LEU A  93
1.48A
None
None
NHE  A 202 (-4.9A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6vxs NSP3
(SARS-CoV-2)
5 / 12
LEU A 126
ALA A 129
PHE A 132
VAL A 142
LEU A 140
1.58A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6vxx SPIKE GLYCOPROTEIN
(SARS-CoV-2)
4 / 4
VAL B 551
LEU B 552
LEU B 585
ASP B 578
1.55A14.44
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6vxx SPIKE GLYCOPROTEIN
(SARS-CoV-2)
5 / 12
LEU B 368
VAL B 367
GLY B 339
VAL B 341
LEU B 513
1.29A14.44
NAG  B1307 (-4.9A)
None
NAG  B1307 (-3.5A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6vyb SPIKE GLYCOPROTEIN
(SARS-CoV-2)
5 / 12
LEU C 368
VAL C 367
GLY C 339
VAL C 341
LEU C 513
1.33A14.44
None
None
NAG  C1306 (-3.5A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6vyb SPIKE GLYCOPROTEIN
(SARS-CoV-2)
4 / 4
VAL C 551
LEU C 552
LEU C 585
ASP C 578
1.55A14.44
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w41 SPIKE PROTEIN S1
(SARS-CoV-2)
5 / 12
LEU C 368
VAL C 367
GLY C 339
VAL C 341
LEU C 513
1.34A19.28
None
None
NAG  C 601 ( 4.0A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6w4b NSP9
(SARS-CoV-2)
5 / 10
LEU B  95
ALA B  44
LEU B  43
GLY B 101
LEU B 104
1.17A15.03
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w4h NSP16
(SARS-CoV-2)
4 / 4
VAL A6882
LEU A6883
LEU A6893
ASP A6895
1.57A20.10
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w61 2'-O-METHYLTRANSFERA
SE
(SARS-CoV-2)
5 / 12
GLY A7011
ALA A6986
GLY A6963
VAL A6965
LEU A6981
1.48A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w61 2'-O-METHYLTRANSFERA
SE
(SARS-CoV-2)
5 / 12
LEU A6924
GLY A6963
VAL A6965
ALA A6966
LEU A7050
1.77A20.49
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w61 2'-O-METHYLTRANSFERA
SE
(SARS-CoV-2)
5 / 12
LEU A6893
ALA A6905
GLY A6879
VAL A6882
LEU A6887
1.67A20.49
None
None
SAM  A7104 (-3.6A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w61 2'-O-METHYLTRANSFERA
SE
(SARS-CoV-2)
5 / 12
LEU A6924
GLY A6963
VAL A6965
ALA A6966
LEU A6887
1.57A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w61 NSP10
(SARS-CoV-2)
5 / 12
LEU B4345
GLY B4347
PHE B4321
VAL B4369
ALA B4314
1.68A15.86
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6w61 2'-O-METHYLTRANSFERA
SE
(SARS-CoV-2)
5 / 10
LEU A7010
LEU A6959
MET A6982
GLY A6983
LEU A6981
1.66A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w61 2'-O-METHYLTRANSFERA
SE
(SARS-CoV-2)
4 / 4
VAL A6882
LEU A6883
LEU A6893
ASP A6895
1.56A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6w63 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 10
LEU A 177
VAL A  20
LEU A  89
LEU A  30
GLY A 146
1.66A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w63 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 12
GLY A 138
PHE A 185
GLY A 170
LEU A 141
ALA A 194
1.60A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w63 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 12
GLY A  29
VAL A  18
ALA A  70
LEU A  67
ALA A  94
1.62A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w6y NSP3
(SARS-CoV-2)
5 / 12
LEU B 123
VAL B  35
ALA B  27
TYR B   9
ALA B  52
1.65A18.35
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w6y NSP3
(SARS-CoV-2)
5 / 12
LEU A  53
VAL A  24
PHE A 156
GLY A  51
HIS A  45
1.78A18.35
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w6y NSP3
(SARS-CoV-2)
5 / 12
GLY B  78
VAL B  77
PHE B 132
LEU B  93
ALA B 134
1.79A18.35
None
None
MES  B 201 ( 3.4A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w6y NSP3
(SARS-CoV-2)
5 / 12
LEU A  75
VAL A  41
ALA A  39
PHE A 132
GLY A  78
1.65A18.35
None
None
None
AMP  A 201 ( 4.3A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w6y NSP3
(SARS-CoV-2)
5 / 12
LEU B  75
VAL B  41
ALA B  39
PHE B 132
GLY B  78
1.57A
None
None
None
MES  B 201 ( 3.4A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6w6y NSP3
(SARS-CoV-2)
5 / 10
LEU A  75
ALA A  39
VAL A  36
LEU A  43
LEU A  93
1.72A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w6y NSP3
(SARS-CoV-2)
5 / 12
LEU A 123
VAL A  35
ALA A  27
TYR A   9
ALA A  52
1.64A18.35
None
None
None
None
AMP  A 201 ( 4.0A)
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w6y NSP3
(SARS-CoV-2)
5 / 12
LEU B  53
VAL B  24
PHE B 156
GLY B  51
HIS B  45
1.73A18.35
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w6y NSP3
(SARS-CoV-2)
5 / 12
LEU A  53
GLY A  51
VAL A  49
HIS A  94
LEU A  88
1.61A
None
None
AMP  A 201 ( 3.7A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w6y NSP3
(SARS-CoV-2)
5 / 12
LEU A 126
ALA A 129
PHE A 132
VAL A 142
LEU A 140
1.54A
AMP  A 201 ( 4.4A)
AMP  A 201 ( 3.4A)
AMP  A 201 ( 4.3A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w6y NSP3
(SARS-CoV-2)
5 / 12
LEU B  53
GLY B  51
VAL B  49
HIS B  94
LEU B  88
1.61A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6w6y NSP3
(SARS-CoV-2)
5 / 10
LEU A 127
ALA A 124
VAL A  34
LEU A 122
LEU A  93
1.49A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w6y NSP3
(SARS-CoV-2)
5 / 12
GLY A   8
ALA A 154
VAL A 151
LEU A  12
ALA A  27
1.76A18.35
None
AMP  A 201 ( 4.5A)
None
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6w6y NSP3
(SARS-CoV-2)
5 / 10
LEU B 127
ALA B 124
VAL B  34
LEU B 122
LEU B  93
1.49A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6w6y NSP3
(SARS-CoV-2)
5 / 10
LEU B  75
ALA B  39
VAL B  36
LEU B  43
LEU B  93
1.72A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w75 NSP10
(SARS-CoV-2)
5 / 12
LEU B4345
GLY B4347
PHE B4321
VAL B4369
ALA B4314
1.70A16.40
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w75 NSP16
(SARS-CoV-2)
5 / 12
LEU C6924
GLY C6963
VAL C6965
ALA C6966
LEU C6887
1.59A20.87
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w75 NSP16
(SARS-CoV-2)
5 / 12
LEU A6893
ALA A6905
GLY A6879
VAL A6882
LEU A6887
1.69A20.87
None
None
SAM  A7102 ( 3.4A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w75 NSP10
(SARS-CoV-2)
5 / 12
LEU D4345
GLY D4347
PHE D4321
VAL D4369
ALA D4314
1.69A16.40
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w75 NSP16
(SARS-CoV-2)
5 / 12
LEU C6893
ALA C6905
GLY C6879
VAL C6882
LEU C6887
1.70A20.87
None
None
SAM  C7105 ( 3.4A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w75 NSP16
(SARS-CoV-2)
4 / 4
VAL C6882
LEU C6883
LEU C6893
ASP C6895
1.57A20.87
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w75 NSP16
(SARS-CoV-2)
5 / 12
LEU A6924
GLY A6963
VAL A6965
ALA A6966
LEU A7050
1.78A20.87
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w75 NSP16
(SARS-CoV-2)
5 / 12
LEU A6924
GLY A6963
VAL A6965
ALA A6966
LEU A6887
1.59A20.87
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w75 NSP16
(SARS-CoV-2)
4 / 4
VAL A6882
LEU A6883
LEU A6893
ASP A6895
1.58A20.87
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6w75 NSP16
(SARS-CoV-2)
5 / 12
LEU C6924
GLY C6963
VAL C6965
ALA C6966
LEU C7050
1.77A20.87
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6w9c PAPAIN-LIKE
PROTEINASE
(SARS-CoV-2)
5 / 10
ALA C 153
LEU C 150
MET C  84
GLY C  81
LEU C  80
1.73A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6w9c PAPAIN-LIKE
PROTEINASE
(SARS-CoV-2)
5 / 10
ARG C 138
ALA C 149
VAL C 159
LEU C 152
LEU C  87
1.61A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6w9c PAPAIN-LIKE
PROTEINASE
(SARS-CoV-2)
5 / 10
ALA B 153
LEU B 150
MET B  84
GLY B  81
LEU B  80
1.70A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6w9c PAPAIN-LIKE
PROTEINASE
(SARS-CoV-2)
5 / 10
ALA A 153
LEU A 150
MET A  84
GLY A  81
LEU A  80
1.70A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6w9c PAPAIN-LIKE
PROTEINASE
(SARS-CoV-2)
5 / 10
LEU A  87
ALA A 149
LEU A 152
LEU A 150
GLY A  81
1.50A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6w9c PAPAIN-LIKE
PROTEINASE
(SARS-CoV-2)
5 / 10
LEU C  87
ALA C 149
LEU C 152
LEU C 150
GLY C  81
1.51A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6w9c PAPAIN-LIKE
PROTEINASE
(SARS-CoV-2)
5 / 10
LEU B  87
ALA B 149
LEU B 152
LEU B 150
GLY B  81
1.53A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6w9q 3C-LIKE PROTEINASE
PEPTIDE, NSP9 FUSION
(SARS-CoV-2)
5 / 10
LEU A  94
ALA A  43
LEU A  88
LEU A  42
LEU A 103
1.64A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6w9q 3C-LIKE PROTEINASE
PEPTIDE, NSP9 FUSION
(SARS-CoV-2)
5 / 10
LEU A  94
ALA A  43
LEU A  42
GLY A 100
LEU A 103
1.17A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6w9q 3C-LIKE PROTEINASE
PEPTIDE, NSP9 FUSION
(SARS-CoV-2)
5 / 10
ALA A  28
VAL A  41
LEU A  44
LEU A  29
MET A  12
1.70A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6w9q 3C-LIKE PROTEINASE
PEPTIDE, NSP9 FUSION
(SARS-CoV-2)
5 / 10
LEU A  69
VAL A 102
LEU A  88
LEU A  44
LEU A  94
1.70A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wcf NSP3
(SARS-CoV-2)
5 / 12
LEU A  53
GLY A  51
VAL A  49
HIS A  94
LEU A  88
1.52A
None
MES  A 202 (-3.3A)
None
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wcf NSP3
(SARS-CoV-2)
4 / 4
VAL A 165
LEU A 164
LEU A 160
ASP A 135
1.43A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6wcf NSP3
(SARS-CoV-2)
5 / 10
LEU A  75
ALA A  39
VAL A  36
LEU A  43
LEU A  93
1.73A
None
MES  A 201 ( 4.7A)
None
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wcf NSP3
(SARS-CoV-2)
5 / 12
LEU A  75
VAL A  41
ALA A  39
PHE A 132
GLY A  78
1.60A
None
None
MES  A 201 ( 4.7A)
MES  A 201 (-2.5A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6wcf NSP3
(SARS-CoV-2)
5 / 10
LEU A 127
ALA A 124
VAL A  34
LEU A 122
LEU A  93
1.52A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6wen NSP3
(SARS-CoV-2)
5 / 10
LEU A 127
ALA A 124
VAL A  34
LEU A 122
LEU A  93
1.54A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wen NSP3
(SARS-CoV-2)
5 / 12
LEU A 126
ALA A 129
PHE A 132
VAL A 142
LEU A 140
1.59A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6wen NSP3
(SARS-CoV-2)
5 / 10
LEU A  75
ALA A  39
VAL A  36
LEU A  43
LEU A  93
1.70A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wen NSP3
(SARS-CoV-2)
5 / 12
LEU A  53
GLY A  51
VAL A  49
HIS A  94
LEU A  88
1.55A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6wey NSP3
(SARS-CoV-2)
5 / 10
LEU A 331
ALA A 328
VAL A 238
LEU A 326
LEU A 297
1.54A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wey NSP3
(SARS-CoV-2)
5 / 12
LEU A 330
ALA A 333
PHE A 336
VAL A 346
LEU A 344
1.58A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6wey NSP3
(SARS-CoV-2)
5 / 10
LEU A 279
ALA A 243
VAL A 240
LEU A 247
LEU A 297
1.73A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wey NSP3
(SARS-CoV-2)
4 / 4
VAL A 369
LEU A 368
LEU A 364
ASP A 339
1.50A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wji NUCLEOCAPSID PROTEIN
(SARS-CoV-2)
5 / 12
ARG D 293
GLY D 295
VAL D 270
GLY D 287
HIS D 356
1.37A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wji NUCLEOCAPSID PROTEIN
(SARS-CoV-2)
5 / 12
ARG E 293
GLY E 295
VAL E 270
GLY E 287
HIS E 356
1.29A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wji NUCLEOCAPSID PROTEIN
(SARS-CoV-2)
5 / 12
ARG F 293
GLY F 295
VAL F 270
GLY F 287
HIS F 356
1.37A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wji NUCLEOCAPSID PROTEIN
(SARS-CoV-2)
5 / 12
ARG A 293
GLY A 295
VAL A 270
GLY A 287
HIS A 356
1.26A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wji NUCLEOCAPSID PROTEIN
(SARS-CoV-2)
5 / 12
ARG C 293
GLY C 295
VAL C 270
GLY C 287
HIS C 356
1.23A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wji NUCLEOCAPSID PROTEIN
(SARS-CoV-2)
5 / 12
ARG B 293
GLY B 295
VAL B 270
GLY B 287
HIS B 356
1.31A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wjt 2'-O-METHYLTRANSFERA
SE
(SARS-CoV-2)
4 / 4
VAL C6882
LEU C6883
LEU C6893
ASP C6895
1.57A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wjt 2'-O-METHYLTRANSFERA
SE
(SARS-CoV-2)
4 / 4
VAL A6882
LEU A6883
LEU A6893
ASP A6895
1.57A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wjt 2'-O-METHYLTRANSFERA
SE
(SARS-CoV-2)
5 / 12
LEU A6924
GLY A6963
VAL A6965
ALA A6966
LEU A6887
1.59A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wjt 2'-O-METHYLTRANSFERA
SE
(SARS-CoV-2)
5 / 12
LEU C6924
GLY C6963
VAL C6965
ALA C6966
LEU C6887
1.59A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wjt 2'-O-METHYLTRANSFERA
SE
(SARS-CoV-2)
5 / 12
GLY A7011
ALA A6986
GLY A6963
VAL A6965
LEU A6981
1.47A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wkq NSP16
(SARS-CoV-2)
5 / 12
LEU A6924
GLY A6963
VAL A6965
ALA A6966
LEU A6887
1.58A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wkq NSP16
(SARS-CoV-2)
4 / 4
VAL A6882
LEU A6883
LEU A6893
ASP A6895
1.57A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wkq NSP16
(SARS-CoV-2)
5 / 12
LEU C6924
GLY C6963
VAL C6965
ALA C6966
LEU C6887
1.58A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wkq NSP16
(SARS-CoV-2)
4 / 4
VAL C6882
LEU C6883
LEU C6893
ASP C6895
1.58A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wlc URIDYLATE-SPECIFIC
ENDORIBONUCLEASE
(SARS-CoV-2)
5 / 12
LEU B  76
GLY B  77
VAL B  78
LEU B 190
ALA B  82
1.49A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wlc URIDYLATE-SPECIFIC
ENDORIBONUCLEASE
(SARS-CoV-2)
5 / 12
LEU A  76
GLY A  77
GLY A 141
LEU A 190
ALA A  82
1.48A
None
EDO  A 406 ( 3.9A)
None
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wlc URIDYLATE-SPECIFIC
ENDORIBONUCLEASE
(SARS-CoV-2)
5 / 12
LEU A 201
ALA A 256
VAL A 295
TYR A 279
LEU A 266
1.30A
EDO  A 405 (-4.1A)
None
None
EDO  A 405 (-4.9A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6wlc URIDYLATE-SPECIFIC
ENDORIBONUCLEASE
(SARS-CoV-2)
5 / 10
VAL A 295
LEU A 252
LEU A 251
GLY A 239
LEU A 249
1.63A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6wlc URIDYLATE-SPECIFIC
ENDORIBONUCLEASE
(SARS-CoV-2)
5 / 10
ALA A 256
VAL A 295
LEU A 252
GLY A 239
LEU A 249
1.69A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wlc URIDYLATE-SPECIFIC
ENDORIBONUCLEASE
(SARS-CoV-2)
5 / 12
LEU B  76
GLY B  77
GLY B 141
LEU B 190
ALA B  82
1.53A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wlc URIDYLATE-SPECIFIC
ENDORIBONUCLEASE
(SARS-CoV-2)
6 / 12
ARG B 136
GLY B 130
ALA B 138
TYR B 180
LEU B 152
ALA B  81
1.74A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wlc URIDYLATE-SPECIFIC
ENDORIBONUCLEASE
(SARS-CoV-2)
5 / 12
LEU B 201
ALA B 256
VAL B 295
TYR B 279
LEU B 266
1.29A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wlc URIDYLATE-SPECIFIC
ENDORIBONUCLEASE
(SARS-CoV-2)
5 / 12
LEU A  76
GLY A  77
VAL A  78
LEU A 190
ALA A  82
1.50A
None
EDO  A 406 ( 3.9A)
None
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6wlc URIDYLATE-SPECIFIC
ENDORIBONUCLEASE
(SARS-CoV-2)
5 / 10
ALA B 256
VAL B 295
LEU B 252
GLY B 239
LEU B 249
1.68A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6wnp 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 10
LEU A 177
VAL A  20
LEU A  89
LEU A  30
GLY A 146
1.67A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wnp 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 12
GLY A  29
VAL A  18
ALA A  70
VAL A  77
ALA A  94
1.55A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6woj REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
LEU A  75
VAL A  41
ALA A  39
PHE A 132
GLY A  78
1.62A
None
None
None
APR  A 201 (-3.1A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6woj REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 10
LEU C 127
ALA C 124
VAL C  34
LEU C 122
LEU C  93
1.50A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6woj REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 10
LEU B 127
ALA B 124
VAL B  34
LEU B 122
LEU B  93
1.44A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6woj REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 10
LEU D 127
ALA D 124
VAL D  34
LEU D 122
LEU D  93
1.44A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6woj REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 10
LEU A 127
ALA A 124
VAL A  34
LEU A 122
LEU A  93
1.51A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6woj REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
LEU C  75
VAL C  41
ALA C  39
PHE C 132
GLY C  78
1.56A
None
None
None
APR  C 201 (-3.5A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6woj REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 10
LEU C  75
ALA C  39
VAL C  36
LEU C  43
LEU C  93
1.73A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6woj REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 10
LEU A  75
ALA A  39
VAL A  36
LEU A  43
LEU A  93
1.70A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6woj REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 10
LEU B  75
ALA B  39
VAL B  36
LEU B  43
LEU B  93
1.72A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6woj REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
LEU D  75
VAL D  41
ALA D  39
PHE D 132
GLY D  78
1.58A
None
None
None
APR  D 201 (-3.5A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6woj REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
LEU B  75
VAL B  41
ALA B  39
PHE B 132
GLY B  78
1.58A
None
None
None
APR  B 201 (-3.6A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6woj REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 10
LEU D  75
ALA D  39
VAL D  36
LEU D  43
LEU D  93
1.67A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wq3 2'-O-METHYLTRANSFERA
SE
(SARS-CoV-2)
5 / 12
LEU A6924
GLY A6963
VAL A6965
ALA A6966
LEU A6887
1.59A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wq3 2'-O-METHYLTRANSFERA
SE
(SARS-CoV-2)
4 / 4
VAL A6882
LEU A6883
LEU A6893
ASP A6895
1.56A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wq3 2'-O-METHYLTRANSFERA
SE
(SARS-CoV-2)
5 / 12
GLY A7011
ALA A6986
GLY A6963
VAL A6965
LEU A6981
1.47A
None
8NK  A7103 ( 3.8A)
None
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6wqf 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 10
LEU A 177
VAL A  20
LEU A  89
LEU A  30
GLY A 146
1.69A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6wqf 3C-LIKE PROTEINASE
(SARS-CoV-2)
5 / 12
GLY A  29
VAL A  18
ALA A  70
VAL A  77
ALA A  94
1.55A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6wrh PEPTIDASE C16
(SARS-CoV-2)
5 / 10
LEU A  87
ALA A 149
LEU A 152
LEU A 150
GLY A  81
1.47A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6wrh PEPTIDASE C16
(SARS-CoV-2)
5 / 10
ALA A 153
LEU A 150
MET A  84
GLY A  81
LEU A  80
1.70A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6wrh PEPTIDASE C16
(SARS-CoV-2)
5 / 10
ARG A 138
ALA A 149
VAL A 159
LEU A 152
LEU A  87
1.40A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6y2f REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 10
VAL A  20
LEU A  89
LEU A  30
GLY A 146
LEU A  27
1.47A21.68
None
None
None
None
O6K  A 502 ( 4.9A)
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6yb7 REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
GLY A 138
ALA A 173
PHE A 185
GLY A 170
ALA A 194
1.71A17.58
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6yb7 REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
GLY A  29
VAL A  18
ALA A  70
VAL A  77
ALA A  94
1.55A17.58
None
None
DMS  A 406 ( 4.1A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6yb7 REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 10
LEU A 177
VAL A  20
LEU A  89
LEU A  30
GLY A 146
1.64A19.52
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6yb7 REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 10
ALA A 211
VAL A 204
LEU A 208
LEU A 282
LEU A 287
1.76A19.52
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6yb7 REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
GLY A 138
PHE A 185
GLY A 170
LEU A 141
ALA A 194
1.57A17.58
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6yhu REPLICASE
POLYPROTEIN 1A
(SARS-CoV-2)
5 / 10
ARG D  96
VAL A  11
LEU D  91
MET D  87
LEU A  40
1.71A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6yhu REPLICASE
POLYPROTEIN 1A
(SARS-CoV-2)
5 / 10
ARG B  96
VAL C  11
LEU B  91
MET B  87
LEU C  40
1.72A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6yla SPIKE GLYCOPROTEIN
(SARS-CoV-2)
4 / 4
VAL A 382
LEU A 387
LEU A 390
ASP A 389
1.78A
DMS  A 905 (-4.3A)
DMS  A 905 ( 4.2A)
DMS  A 905 (-4.9A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6yla SPIKE GLYCOPROTEIN
(SARS-CoV-2)
5 / 12
LEU A 368
VAL A 367
GLY A 339
VAL A 341
LEU A 513
1.39A
None
NAG  A 904 (-4.5A)
NAG  A 904 ( 3.7A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6yla SPIKE GLYCOPROTEIN
(SARS-CoV-2)
5 / 12
LEU E 368
VAL E 367
GLY E 339
VAL E 341
LEU E 513
1.41A
None
None
NAG  E 907 ( 4.0A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ym0 SPIKE GLYCOPROTEIN
(SARS-CoV-2)
5 / 12
LEU E 368
VAL E 367
GLY E 339
VAL E 341
LEU E 513
1.45A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ym0 SPIKE GLYCOPROTEIN
(SARS-CoV-2)
4 / 4
VAL E 382
LEU E 387
LEU E 390
ASP E 389
1.71A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ynq REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
GLY A 138
PHE A 185
GLY A 170
LEU A 141
ALA A 194
1.50A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ynq REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 10
LEU A 177
VAL A  20
LEU A  89
LEU A  30
GLY A 146
1.63A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ynq REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
GLY A  29
VAL A  18
ALA A  70
VAL A  77
ALA A  94
1.61A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6yor SPIKE GLYCOPROTEIN
(SARS-CoV-2)
5 / 12
LEU E 368
VAL E 367
GLY E 339
VAL E 341
LEU E 513
1.41A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6yor SPIKE GLYCOPROTEIN
(SARS-CoV-2)
5 / 12
LEU A 368
VAL A 367
GLY A 339
VAL A 341
LEU A 513
1.41A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6yt8 REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
GLY A  29
VAL A  18
ALA A  70
VAL A  77
ALA A  94
1.59A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6yt8 REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 10
ALA A 211
VAL A 204
LEU A 208
LEU A 282
LEU A 287
1.72A
None
None
None
None
PEG  A 404 (-2.9A)
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6yt8 REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 10
LEU A 220
ALA A 211
VAL A 296
LEU A 208
LEU A 253
1.77A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6yt8 REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 10
VAL A  20
LEU A  89
LEU A  30
GLY A 146
LEU A  27
1.51A
None
None
None
None
PK8  A 401 ( 3.6A)
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6yt8 REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 10
LEU A 177
VAL A  20
LEU A  89
LEU A  30
GLY A 146
1.66A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6yt8 REPLICASE
POLYPROTEIN 1AB
(SARS-CoV-2)
5 / 12
GLY A 138
PHE A 185
GLY A 170
LEU A 141
ALA A 194
1.45A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU D 126
ALA D 129
PHE D 132
VAL D 142
LEU D 140
1.58A
None
EDO  D 205 (-4.5A)
EDO  D 205 ( 3.6A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU C  75
ALA C  39
VAL C  36
LEU C  43
LEU C  93
1.72A
EPE  C 202 (-3.4A)
None
None
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU A 126
ALA A 129
PHE A 132
VAL A 142
LEU A 140
1.63A
None
None
EDO  A 202 (-3.9A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU D  75
VAL D  41
ALA D  39
PHE D 132
GLY D  78
1.63A
None
None
None
EDO  D 205 ( 3.6A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU D 127
ALA D 124
VAL D  34
LEU D 122
LEU D  93
1.49A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU A 127
ALA A 124
VAL A  34
LEU A 122
LEU A  93
1.50A
EDO  A 202 ( 4.8A)
None
None
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU B  53
GLY B  51
VAL B  49
HIS B  94
LEU B  88
1.62A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU B 126
ALA B 129
PHE B 132
VAL B 142
LEU B 140
1.55A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU D  75
ALA D  39
VAL D  36
LEU D  43
LEU D  93
1.67A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU D  53
GLY D  51
VAL D  49
HIS D  94
LEU D  88
1.61A
None
None
EDO  D 209 (-4.6A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU D 169
VAL D 155
LEU D 153
LEU D  10
LEU D 164
1.70A
None
EDO  D 208 ( 4.2A)
None
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU C 127
ALA C 124
VAL C  34
LEU C 122
LEU C  93
1.48A
None
None
EDO  C 207 (-4.8A)
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
4 / 4
VAL A 165
LEU A 164
LEU A 160
ASP A 135
1.54A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU B 127
ALA B 124
VAL B  34
LEU B 122
LEU B  93
1.52A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU B  75
ALA B  39
VAL B  36
LEU B  43
LEU B  93
1.69A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU A  75
ALA A  39
VAL A  36
LEU A  43
LEU A  93
1.69A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU A  75
VAL A  41
ALA A  39
PHE A 132
GLY A  78
1.61A
None
None
None
EDO  A 202 (-3.9A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU E  75
ALA E  39
VAL E  36
LEU E  43
LEU E  93
1.72A
EPE  E 203 (-3.6A)
None
None
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU E  75
VAL E  41
ALA E  39
PHE E 132
GLY E  78
1.59A
EPE  E 203 (-3.6A)
None
None
EPE  E 202 (-3.2A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU C 126
ALA C 129
PHE C 132
VAL C 142
LEU C 140
1.58A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU C  53
GLY C  51
VAL C  49
HIS C  94
LEU C  88
1.53A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywk NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU E 127
ALA E 124
VAL E  34
LEU E 122
LEU E  93
1.51A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU A  75
VAL A  41
ALA A  39
PHE A 132
GLY A  78
1.57A
None
None
None
APR  A 201 (-3.7A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU B 127
ALA B 124
VAL B  34
LEU B 122
LEU B  93
1.53A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU E  75
ALA E  39
VAL E  36
LEU E  43
LEU E  93
1.71A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU E  75
VAL E  41
ALA E  39
PHE E 132
GLY E  78
1.59A
None
None
None
APR  E 201 (-3.5A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU D  75
VAL D  41
ALA D  39
PHE D 132
GLY D  78
1.60A
EDO  D 202 (-4.6A)
None
None
APR  D 201 (-3.3A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU D 169
VAL D 155
LEU D 153
LEU D  10
LEU D 164
1.66A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU D  75
ALA D  39
VAL D  36
LEU D  43
LEU D  93
1.67A
EDO  D 202 (-4.6A)
None
None
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU A  75
ALA A  39
VAL A  36
LEU A  43
LEU A  93
1.66A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU C 127
ALA C 124
VAL C  34
LEU C 122
LEU C  93
1.48A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU D 127
ALA D 124
VAL D  34
LEU D 122
LEU D  93
1.47A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU A 127
ALA A 124
VAL A  34
LEU A 122
LEU A  93
1.49A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU C  75
VAL C  41
ALA C  39
PHE C 132
GLY C  78
1.58A
None
None
None
APR  C 201 (-3.5A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
4 / 4
VAL A 165
LEU A 164
LEU A 160
ASP A 135
1.53A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU C  75
ALA C  39
VAL C  36
LEU C  43
LEU C  93
1.71A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU B  75
ALA B  39
VAL B  36
LEU B  43
LEU B  93
1.68A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU D  53
VAL D  24
PHE D 156
GLY D  48
ALA C  60
1.60A
None
None
EDO  D 204 (-3.9A)
EDO  D 204 ( 3.4A)
EDO  D 204 ( 4.8A)
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU E  93
VAL E  82
VAL E 147
TYR E 113
LEU E 127
1.61A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU E 127
ALA E 124
VAL E  34
LEU E 122
LEU E  93
1.49A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywl NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU B  75
VAL B  41
ALA B  39
PHE B 132
GLY B  78
1.58A
None
None
None
APR  B 201 (-3.5A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywm NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU C  53
GLY C  51
VAL C  49
HIS C  94
LEU C  88
1.61A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywm NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU C 127
ALA C 124
VAL C  34
LEU C 122
LEU C  93
1.48A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywm NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU B 127
ALA B 124
VAL B  34
LEU B 122
LEU B  93
1.51A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywm NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU B  53
GLY B  51
VAL B  49
HIS B  94
LEU B  88
1.62A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywm NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU B 169
VAL B 155
LEU B 153
LEU B  10
LEU B 164
1.72A
None
EDO  B 202 (-4.0A)
None
None
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywm NSP3 MACRODOMAIN
(SARS-CoV-2)
4 / 4
VAL A 165
LEU A 164
LEU A 160
ASP A 135
1.56A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywm NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU C  75
ALA C  39
VAL C  36
LEU C  43
LEU C  93
1.71A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywm NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU A  75
VAL A  41
ALA A  39
PHE A 132
GLY A  78
1.61A
None
None
None
MES  A 201 (-3.5A)
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywm NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU A 127
ALA A 124
VAL A  34
LEU A 122
LEU A  93
1.50A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywm NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU A  75
ALA A  39
VAL A  36
LEU A  43
LEU A  93
1.69A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6ywm NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 12
LEU A  53
GLY A  51
VAL A  49
HIS A  94
LEU A  88
1.60A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6ywm NSP3 MACRODOMAIN
(SARS-CoV-2)
5 / 10
LEU B  75
ALA B  39
VAL B  36
LEU B  43
LEU B  93
1.72A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
7bqy MAIN PROTEASE
(SARS-CoV-2)
5 / 10
VAL A  20
LEU A  89
LEU A  30
GLY A 146
LEU A  27
1.51A
None
None
None
None
PJE  C   5 (-4.2A)
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
7bqy MAIN PROTEASE
(SARS-CoV-2)
5 / 10
LEU A 177
VAL A  20
LEU A  89
LEU A  30
GLY A 146
1.66A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
7bqy MAIN PROTEASE
(SARS-CoV-2)
5 / 12
GLY A  29
VAL A  18
ALA A  70
VAL A  77
ALA A  94
1.54A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
7bqy MAIN PROTEASE
(SARS-CoV-2)
5 / 10
LEU A 220
ALA A 211
VAL A 296
LEU A 208
LEU A 253
1.78A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
7btf NSP12
(SARS-CoV-2)
5 / 12
ARG A 132
ALA A  34
GLY A  44
TYR A 732
LEU A 240
1.47A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
7btf NSP12
(SARS-CoV-2)
5 / 12
GLY A 345
VAL A 535
ALA A 656
GLY A 352
HIS A 347
1.32A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
7btf NSP7
(SARS-CoV-2)
4 / 4
VAL C  53
LEU C  56
LEU C  60
ASP C  67
1.43A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
7btf NSP12
(SARS-CoV-2)
5 / 12
VAL A 342
ALA A 379
GLY A 345
HIS A 355
TYR A 273
1.25A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
7btf NSP12
(SARS-CoV-2)
5 / 12
GLY A 203
VAL A 204
GLY A 220
HIS A  82
LEU A  90
1.43A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
7btf NSP12
(SARS-CoV-2)
5 / 10
ALA A 866
VAL A 880
LEU A 869
GLY A 841
LEU A 838
1.51A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
7btf NSP12
(SARS-CoV-2)
5 / 10
ALA A 866
VAL A 880
LEU A 862
GLY A 839
LEU A 838
1.77A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
7buy VIRUS MAIN PROTEASE
(SARS-CoV-2)
5 / 10
LEU A 177
VAL A  20
LEU A  89
LEU A  30
GLY A 146
1.67A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
7buy VIRUS MAIN PROTEASE
(SARS-CoV-2)
5 / 12
GLY A 138
PHE A 185
GLY A 170
LEU A 141
ALA A 194
1.56A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
7bv1 NSP12
(SARS-CoV-2)
5 / 12
GLY A 345
VAL A 535
ALA A 656
GLY A 352
HIS A 347
1.29A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
7bv1 NSP12
(SARS-CoV-2)
5 / 10
ALA A 866
VAL A 880
LEU A 869
GLY A 841
LEU A 838
1.58A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
7bv1 NSP12
(SARS-CoV-2)
5 / 12
LEU A 329
GLY A 345
VAL A 330
GLY A 327
ALA A 382
1.63A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
7bv1 NSP12
(SARS-CoV-2)
4 / 4
VAL A 472
LEU A 470
LEU A 308
ASP A 304
1.77A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
7bv1 NSP12
(SARS-CoV-2)
5 / 12
VAL A 342
ALA A 379
GLY A 345
HIS A 355
TYR A 273
1.35A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
7bv1 NSP12
(SARS-CoV-2)
5 / 12
ARG A 132
ALA A  34
GLY A  44
TYR A 732
LEU A 240
1.46A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
7bv1 NSP7
NSP8
(SARS-CoV-2)
4 / 4
VAL C  53
LEU D 103
LEU D  98
ASP C   5
1.78A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
7bv1 NSP12
(SARS-CoV-2)
5 / 10
ALA A 866
VAL A 880
LEU A 869
GLY A 839
LEU A 838
1.74A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
7bv1 NSP12
(SARS-CoV-2)
5 / 10
ALA A 639
LYS A 641
VAL A 693
LEU A 636
MET A 633
1.71A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
7bv1 NSP12
(SARS-CoV-2)
5 / 10
LEU A 186
ALA A 250
VAL A 320
LEU A 245
LEU A 282
1.33A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
7bv2 NSP12
(SARS-CoV-2)
5 / 12
ARG A 132
ALA A  34
GLY A  44
TYR A 732
LEU A 240
1.54A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
7bv2 NSP12
(SARS-CoV-2)
5 / 12
VAL A 342
ALA A 379
GLY A 345
HIS A 355
TYR A 273
1.27A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
7bv2 NSP12
(SARS-CoV-2)
5 / 10
LYS A 641
VAL A 693
LEU A 638
LEU A 636
MET A 633
1.52A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
7bv2 NSP12
NSP8
(SARS-CoV-2)
5 / 12
GLY A 503
ALA A 512
GLY A 510
VAL B  83
LEU A 372
1.61A
None
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
7bv2 NSP12
(SARS-CoV-2)
5 / 12
GLY A 345
VAL A 535
ALA A 656
GLY A 352
HIS A 347
1.40A
None