POTENTIAL TARGETS FROM HUMAN (RESULTS FROM SUB-STRUCTURAL SIMILARITY SEARCHES)
1) User may click on the DrReposER ID (the second 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 through AutoDock Vina.

DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 Interface HETATM RMSD Seq.
Identity (%)		 View 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.
1OXR_A_AINA141_1
(PHOSPHOLIPASE A2
ISOFORM 3)		2lnl C-X-C CHEMOKINE
RECEPTOR TYPE 1
(Homo
sapiens)		4 / 4LEU A 262
GLY A 284
ASP A 288
TYR A 258
None
1.41A17.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OXR_A_AINA141_1
(PHOSPHOLIPASE A2
ISOFORM 3)		2r0l HEPATOCYTE GROWTH
FACTOR ACTIVATOR
(Homo
sapiens)		4 / 4LEU A 199
GLY A 184
ASP A 189
TYR A 228
None
1.32A20.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OXR_A_AINA141_1
(PHOSPHOLIPASE A2
ISOFORM 3)		5brr TISSUE-TYPE
PLASMINOGEN
ACTIVATOR
(Homo
sapiens)		4 / 4LEU E 199
GLY E 184
ASP E 189
TYR E 228
None
1.29A18.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2QQT_A_AINA596_1
(LACTOPEROXIDASE)		1d7w MYELOPEROXIDASE
(Homo
sapiens)		4 / 6HIS A  95
ARG C 239
GLU C 242
PHE C 366
CYN  A1844 (-4.1A)
HEM  A 605 (-4.3A)
HEM  A 605 (-2.1A)
None
0.66A38.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2QQT_A_AINA596_1
(LACTOPEROXIDASE)		1d7w MYELOPEROXIDASE
(Homo
sapiens)		4 / 6HIS A  95
ARG C 239
GLU C 242
PRO C 220
CYN  A1844 (-4.1A)
HEM  A 605 (-4.3A)
HEM  A 605 (-2.1A)
None
1.24A38.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QQT_A_AINA596_1
(LACTOPEROXIDASE)		1h9e LAMINA-ASSOCIATED
POLYPEPTIDE 2
(Homo
sapiens)		4 / 6ARG A  49
GLU A   5
PHE A   3
PRO A   7
None
1.33A8.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QQT_A_AINA596_1
(LACTOPEROXIDASE)		2nbr GAMMA-CRYSTALLIN C
(Homo
sapiens)		4 / 6GLU A  61
PHE A  11
GLN A  67
PRO A  63
None
1.27A15.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QQT_A_AINA596_1
(LACTOPEROXIDASE)		2p28 INTEGRIN BETA-2
(Homo
sapiens)		4 / 6ARG B 426
GLU B 424
GLN B 422
PRO A  59
None
1.27A16.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QQT_A_AINA596_1
(LACTOPEROXIDASE)		3a6p EXPORTIN-5
(Homo
sapiens)		4 / 6ARG A 126
GLU A 127
GLN A 130
PRO A 129
None
1.41A19.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QQT_A_AINA596_1
(LACTOPEROXIDASE)		3hig AMILORIDE-SENSITIVE
AMINE OXIDASE
(Homo
sapiens)		4 / 6HIS A 340
ARG A 345
PHE A 701
GLN A 583
None
1.40A21.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QQT_A_AINA596_1
(LACTOPEROXIDASE)		4qgk FATTY ALDEHYDE
DEHYDROGENASE
(Homo
sapiens)		4 / 6GLU A 207
PHE A 182
GLN A 120
PRO A 121
None
1.05A21.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QQT_A_AINA596_1
(LACTOPEROXIDASE)		4zdh BETA CHAIN OF JKF6
T-CELL
RECEPTOR,PROTEIN
TRBV28
(Homo
sapiens)		4 / 6HIS B 153
ARG B 109
GLN B   6
PRO B 106
None
1.33A16.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QQT_A_AINA596_1
(LACTOPEROXIDASE)		5euo PF6 TCR BETA CHAIN
(Homo
sapiens)		4 / 6HIS F 150
ARG F 106
GLN F   4
PRO F 103
None
1.35A18.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QQT_A_AINA596_1
(LACTOPEROXIDASE)		6caj TRANSLATION
INITIATION FACTOR
EIF-2B SUBUNIT BETA
(Homo
sapiens)		4 / 6ARG C 172
GLU C  32
PHE C 272
PRO C 270
None
1.29A8.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3GCL_A_AINA609_1
(LACTOPEROXIDASE)		1d7w MYELOPEROXIDASE
(Homo
sapiens)		4 / 6HIS A  95
ARG C 239
GLU C 242
PHE C 366
CYN  A1844 (-4.1A)
HEM  A 605 (-4.3A)
HEM  A 605 (-2.1A)
None
0.72A38.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3GCL_A_AINA609_1
(LACTOPEROXIDASE)		1d7w MYELOPEROXIDASE
(Homo
sapiens)		4 / 6HIS A  95
ARG C 239
GLU C 242
PRO C 220
CYN  A1844 (-4.1A)
HEM  A 605 (-4.3A)
HEM  A 605 (-2.1A)
None
1.18A38.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GCL_A_AINA609_1
(LACTOPEROXIDASE)		1h9e LAMINA-ASSOCIATED
POLYPEPTIDE 2
(Homo
sapiens)		4 / 6ARG A  49
GLU A   5
PHE A   3
PRO A   7
None
1.13A8.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GCL_A_AINA609_1
(LACTOPEROXIDASE)		1q7l AMINOACYLASE-1
(Homo
sapiens)		4 / 6HIS B 373
GLU A 175
PHE A 187
PRO B 344
 ZN  A1001 ( 3.2A)
ZN  A1002 ( 1.9A)
None
None
1.29A9.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GCL_A_AINA609_1
(LACTOPEROXIDASE)		2nbr GAMMA-CRYSTALLIN C
(Homo
sapiens)		4 / 6GLU A  61
PHE A  11
GLN A  67
PRO A  63
None
1.32A15.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GCL_A_AINA609_1
(LACTOPEROXIDASE)		2p28 INTEGRIN BETA-2
(Homo
sapiens)		4 / 6ARG B 426
GLU B 424
GLN B 422
PRO A  59
None
1.26A16.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GCL_A_AINA609_1
(LACTOPEROXIDASE)		2ro1 TRANSCRIPTION
INTERMEDIARY FACTOR
1-BETA
(Homo
sapiens)		4 / 6ARG A 706
GLU A 705
PHE A 761
PRO A 758
None
1.38A16.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GCL_A_AINA609_1
(LACTOPEROXIDASE)		4zdh BETA CHAIN OF JKF6
T-CELL
RECEPTOR,PROTEIN
TRBV28
(Homo
sapiens)		4 / 6HIS B 153
ARG B 109
GLN B   6
PRO B 106
None
1.32A16.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GCL_A_AINA609_1
(LACTOPEROXIDASE)		5euo PF6 TCR BETA CHAIN
(Homo
sapiens)		4 / 6HIS F 150
ARG F 106
GLN F   4
PRO F 103
None
1.33A18.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GCL_A_AINA609_1
(LACTOPEROXIDASE)		6caj TRANSLATION
INITIATION FACTOR
EIF-2B SUBUNIT BETA
(Homo
sapiens)		4 / 6ARG C 172
GLU C  32
PHE C 272
PRO C 270
None
1.23A8.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IAZ_A_AINA1202_1
(LACTOTRANSFERRIN)		1g25 CDK-ACTIVATING
KINASE ASSEMBLY
FACTOR MAT1
(Homo
sapiens)		3 / 3GLU A  48
GLY A  50
THR A  51
None
None
ZN  A  67 ( 4.5A)
0.49A10.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IAZ_A_AINA1202_1
(LACTOTRANSFERRIN)		1g82 FIBROBLAST GROWTH
FACTOR 9
(Homo
sapiens)		3 / 3GLU A 123
GLY A 175
THR A 176
None
0.58A17.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IAZ_A_AINA1202_1
(LACTOTRANSFERRIN)		1jmc PROTEIN (REPLICATION
PROTEIN A (RPA))
(Homo
sapiens)		3 / 3GLU A 283
GLY A 260
THR A 261
None
0.42A20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IAZ_A_AINA1202_1
(LACTOTRANSFERRIN)		1lpj RETINOL-BINDING
PROTEIN IV, CELLULAR
(Homo
sapiens)		3 / 3GLU A  43
GLY A   6
THR A   7
None
0.47A19.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IAZ_A_AINA1202_1
(LACTOTRANSFERRIN)		1ua2 CELL DIVISION
PROTEIN KINASE 7
(Homo
sapiens)		3 / 3GLU A 227
GLY A 230
THR A 231
None
0.48A22.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IAZ_A_AINA1202_1
(LACTOTRANSFERRIN)		1uep MEMBRANE ASSOCIATED
GUANYLATE KINASE
INVERTED-2 (MAGI-2)
(Homo
sapiens)		3 / 3GLU A  31
GLY A  29
THR A  71
None
0.52A15.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IAZ_A_AINA1202_1
(LACTOTRANSFERRIN)		2kny LRP-1, LINKER, APO-E
(Homo
sapiens)		3 / 3GLU A 131
GLY A  51
THR A  50
None
0.56A15.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IAZ_A_AINA1202_1
(LACTOTRANSFERRIN)		2m0o PHD FINGER PROTEIN 1
(Homo
sapiens)		3 / 3GLU A  66
GLY A  49
THR A  50
None
0.56A13.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IAZ_A_AINA1202_1
(LACTOTRANSFERRIN)		2v9q ROUNDABOUT HOMOLOG 1
(Homo
sapiens)		3 / 3GLU A 250
GLY A 242
THR A 243
None
0.58A23.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IAZ_A_AINA1202_1
(LACTOTRANSFERRIN)		3c49 POLY(ADP-RIBOSE)
POLYMERASE 3
(Homo
sapiens)		3 / 3GLU A 344
GLY A 347
THR A 346
None
0.55A23.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IAZ_A_AINA1202_1
(LACTOTRANSFERRIN)		3gp0 MITOGEN-ACTIVATED
PROTEIN KINASE 11
(Homo
sapiens)		3 / 3GLU A 237
GLY A 240
THR A 241
None
0.46A19.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IAZ_A_AINA1202_1
(LACTOTRANSFERRIN)		3j2i PROLIFERATION-ASSOCI
ATED PROTEIN 2G4
(Homo
sapiens)		3 / 3GLU A  58
GLY A  61
THR A  60
None
0.55A21.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IAZ_A_AINA1202_1
(LACTOTRANSFERRIN)		3l6a EUKARYOTIC
TRANSLATION
INITIATION FACTOR 4
GAMMA 2
(Homo
sapiens)		3 / 3GLU A 129
GLY A 131
THR A 132
MES  A 361 (-3.4A)
None
PG4  A 364 (-4.5A)
0.55A20.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IAZ_A_AINA1202_1
(LACTOTRANSFERRIN)		3lgg ADENOSINE DEAMINASE
CECR1
(Homo
sapiens)		3 / 3GLU A 302
GLY A 305
THR A 304
None
0.56A19.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IAZ_A_AINA1202_1
(LACTOTRANSFERRIN)		4s0h T-BOX TRANSCRIPTION
FACTOR TBX5
(Homo
sapiens)		3 / 3GLU A  69
GLY A  71
THR A  72
None
0.59A17.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IAZ_A_AINA1202_1
(LACTOTRANSFERRIN)		5d39 SIGNAL TRANSDUCER
AND ACTIVATOR OF
TRANSCRIPTION 6
(Homo
sapiens)		3 / 3GLU A 185
GLY A 188
THR A 187
None
0.55A20.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IAZ_A_AINA1202_1
(LACTOTRANSFERRIN)		6avo PROTEASOME SUBUNIT
BETA TYPE-8
(Homo
sapiens)		3 / 3GLU C 116
GLY C 118
THR C 119
None
0.59A13.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4NSB_A_AINA402_1
(CHITINASE-3-LIKE
PROTEIN 1)		1hjv CHITINASE-3 LIKE
PROTEIN 1
(Homo
sapiens)		5 / 7THR A  29
TRP A  31
ARG A  35
TRP A 352
LEU A 356
None
NAG  A  -2 (-4.2A)
None
NAG  A  -1 (-3.5A)
NAG  A  -2 (-4.9A)
0.53A82.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4NSB_A_AINA402_1
(CHITINASE-3-LIKE
PROTEIN 1)		1hkk CHITOTRIOSIDASE-1
(Homo
sapiens)		5 / 7THR A  29
TRP A  31
ARG A  35
TRP A 358
LEU A 362
None
NAA  A1386 (-4.0A)
None
AMI  A1388 (-3.5A)
None
0.45A50.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4NSB_A_AINA402_1
(CHITINASE-3-LIKE
PROTEIN 1)		1wb0 CHITOTRIOSIDASE 1
(Homo
sapiens)		5 / 7THR A  29
TRP A  31
ARG A  35
TRP A 360
LEU A 364
None
0.45A44.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4NSB_A_AINA402_1
(CHITINASE-3-LIKE
PROTEIN 1)		2ybu ACIDIC MAMMALIAN
CHITINASE
(Homo
sapiens)		5 / 7THR A  29
TRP A  31
ARG A  35
TRP A 360
LEU A 364
GOL  A1397 ( 4.8A)
CX9  A1398 ( 3.4A)
GOL  A1397 (-4.2A)
CX9  A1398 ( 3.3A)
None
0.43A49.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NSB_A_AINA402_1
(CHITINASE-3-LIKE
PROTEIN 1)		3hig AMILORIDE-SENSITIVE
AMINE OXIDASE
(Homo
sapiens)		4 / 7THR A 625
TRP A 668
TRP A 617
LEU A 654
None
1.44A18.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4NSB_A_AINA402_1
(CHITINASE-3-LIKE
PROTEIN 1)		4ay1 CHITINASE-3-LIKE
PROTEIN 2
(Homo
sapiens)		4 / 7THR A  34
TRP A  36
ARG A  40
TRP A 360
None
NAG  A 400 (-4.3A)
None
NAG  A 401 (-3.7A)
0.75A49.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NSB_A_AINA402_1
(CHITINASE-3-LIKE
PROTEIN 1)		6ckv BCL-2-RELATED
OVARIAN KILLER
PROTEIN
(Homo
sapiens)		4 / 7TRP A 164
TRP A 120
TRP A 171
LEU A  27
None
1.24A11.17