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.
6F5U_A_CQNA610_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN,GP1
ENVELOPE
GLYCOPROTEIN)
1ua2 CELL DIVISION
PROTEIN KINASE 7
(Homo
sapiens)
5 / 10ALA A 116
LEU A 206
LEU A 145
THR A 302
LEU A  98
None
0.89A14.02
14.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F5U_A_CQNA610_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN,GP1
ENVELOPE
GLYCOPROTEIN)
2qqk NEUROPILIN-2
(Homo
sapiens)
5 / 10VAL A 407
LEU A 339
LEU A 398
LEU A 422
LEU A 424
None
0.82A10.04
11.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F5U_A_CQNA610_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN,GP1
ENVELOPE
GLYCOPROTEIN)
2qqo NEUROPILIN-2
(Homo
sapiens)
5 / 10VAL A 407
LEU A 339
LEU A 398
LEU A 422
LEU A 424
None
0.83A12.17
10.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F5U_A_CQNA610_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN,GP1
ENVELOPE
GLYCOPROTEIN)
2xy9 ANGIOTENSIN-CONVERTI
NG ENZYME
(Homo
sapiens)
5 / 10VAL A 251
ALA A 254
LEU A 247
LEU A 603
LEU A 452
None
0.95A9.21
9.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F5U_A_CQNA610_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN,GP1
ENVELOPE
GLYCOPROTEIN)
3q71 POLY [ADP-RIBOSE]
POLYMERASE 14
(Homo
sapiens)
5 / 10VAL A1031
ALA A1128
LEU A1084
LEU A1046
LEU A1050
None
None
None
AR6  A 800 (-3.6A)
None
0.99A19.15
15.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F5U_A_CQNA610_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN,GP1
ENVELOPE
GLYCOPROTEIN)
4b3g DNA-BINDING PROTEIN
SMUBP-2
(Homo
sapiens)
5 / 10ALA A 350
LEU A 280
LEU A 361
THR A 351
LEU A 342
None
None
None
A  G   8 ( 2.6A)
None
0.97A9.60
8.49
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.
6F5U_A_CQNA610_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN,GP1
ENVELOPE
GLYCOPROTEIN)
4cnm TROPHOBLAST
GLYCOPROTEIN
(Homo
sapiens)
5 / 10ALA A 137
LEU A 144
LEU A 175
LEU A 125
LEU A 123
None
0.92A13.71
15.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F5U_A_CQNA610_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN,GP1
ENVELOPE
GLYCOPROTEIN)
4fp9 MTERF
DOMAIN-CONTAINING
PROTEIN 2
(Homo
sapiens)
5 / 10LEU B 180
LEU B 176
LEU B 154
MET B 159
LEU B 151
None
0.99A11.52
15.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F5U_A_CQNA610_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN,GP1
ENVELOPE
GLYCOPROTEIN)
4iqh DYSFERLIN
(Homo
sapiens)
5 / 10VAL A 123
ALA A 101
LEU A   3
LEU A  61
LEU A  67
None
1.00A22.96
15.79
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.
6F5U_A_CQNA610_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN,GP1
ENVELOPE
GLYCOPROTEIN)
4qdr NEUROPILIN-2
(Homo
sapiens)
5 / 10VAL A 407
LEU A 339
LEU A 398
LEU A 422
LEU A 424
None
0.89A15.60
13.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F5U_A_CQNA610_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN,GP1
ENVELOPE
GLYCOPROTEIN)
4qds NEUROPILIN-2
(Homo
sapiens)
5 / 10VAL A 407
LEU A 339
LEU A 398
LEU A 422
LEU A 424
None
0.89A18.42
20.35
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.
6F5U_A_CQNA610_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN,GP1
ENVELOPE
GLYCOPROTEIN)
5dn2 NEUROPILIN-2
(Homo
sapiens)
5 / 10VAL A 407
LEU A 339
LEU A 398
LEU A 422
LEU A 424
None
0.84A22.76
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F5U_A_CQNA610_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN,GP1
ENVELOPE
GLYCOPROTEIN)
5fhx ANTIBODY FRAGMENT
HEAVY-CHAIN
(Homo
sapiens)
5 / 10ALA H 215
LEU H 142
LEU H 209
LEU H 172
LEU H 204
None
0.91A11.92
13.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F5U_A_CQNA610_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN,GP1
ENVELOPE
GLYCOPROTEIN)
5vhf 26S PROTEASOME
NON-ATPASE
REGULATORY SUBUNIT 3
(Homo
sapiens)
5 / 10VAL V 367
ALA V 366
LEU V 337
LEU V 379
LEU V 398
None
0.87A17.78
18.86
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.
6F5U_A_CQNA610_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN,GP1
ENVELOPE
GLYCOPROTEIN)
5vhs 26S PROTEASOME
NON-ATPASE
REGULATORY SUBUNIT 3
(Homo
sapiens)
5 / 10VAL V 367
ALA V 366
LEU V 337
LEU V 379
LEU V 398
None
0.88A10.42
9.41