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.
3APW_A_DP0A190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
1hjv CHITINASE-3 LIKE
PROTEIN 1
(Homo
sapiens)
5 / 12TYR A  27
VAL A  25
ALA A 138
SER A  95
SER A 175
NAG  A  -1 (-3.8A)
None
NAG  A  -1 ( 3.9A)
None
None
1.36A19.56
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.
3APW_A_DP0A190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
1hlg LIPASE, GASTRIC
(Homo
sapiens)
5 / 12VAL A 366
ILE A 370
PHE A 176
PHE A 160
ALA A 327
None
1.20A17.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3APW_A_DP0A190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
1lpb LIPASE
(Homo
sapiens)
5 / 12PHE B 386
TYR B 340
VAL B 342
ILE B 420
SER B 388
None
1.05A17.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3APW_A_DP0A190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
1p9o PHOSPHOPANTOTHENOYLC
YSTEINE SYNTHETASE
(Homo
sapiens)
5 / 12TYR A 176
VAL A 256
ILE A 269
ALA A  72
SER A  69
None
1.36A20.97
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.
3APW_A_DP0A190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
2xa7 AP-2 COMPLEX SUBUNIT
BETA
(Homo
sapiens)
5 / 12VAL B 310
ILE B 306
PHE B 369
GLU B 337
ALA B 376
None
1.32A14.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3APW_A_DP0A190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
3apu ALPHA-1-ACID
GLYCOPROTEIN 2
(Homo
sapiens)
12 / 12TYR A  27
PHE A  32
TYR A  37
VAL A  41
ILE A  44
PHE A  49
PHE A  51
GLU A  64
ALA A  99
SER A 114
SER A 125
TYR A 127
PG4  A 190 ( 3.8A)
None
None
PG4  A 190 (-4.9A)
None
PG4  A 190 ( 4.1A)
None
PG4  A 190 (-4.1A)
PG4  A 190 ( 4.2A)
None
PG4  A 190 ( 3.7A)
None
0.50A100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3APW_A_DP0A190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
3kq0 ALPHA-1-ACID
GLYCOPROTEIN 1
(Homo
sapiens)
10 / 12TYR A  27
PHE A  32
VAL A  41
ILE A  44
PHE A  49
PHE A  51
GLU A  64
ALA A  99
SER A 125
TYR A 127
None
None
None
None
JIM  A 193 (-3.8A)
None
None
JIM  A 193 ( 4.0A)
None
None
0.73A86.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3APW_A_DP0A190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
4bpc RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE S
(Homo
sapiens)
5 / 12PHE A1859
TYR A1818
VAL A1863
ILE A1775
PHE A1823
None
1.40A17.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3APW_A_DP0A190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
4pj3 INTRON-BINDING
PROTEIN AQUARIUS
(Homo
sapiens)
5 / 12PHE A 123
VAL A 166
ILE A 170
PHE A 253
ALA A 130
None
1.34A8.07
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.
3APW_A_DP0A190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
5l7k PROTEIN UNC-119
HOMOLOG A
(Homo
sapiens)
5 / 12ILE A 105
PHE A 133
PHE A 137
SER A 218
TYR A 131
None
1.47A23.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3APW_A_DP0A190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
5nfb GALECTIN-3
(Homo
sapiens)
5 / 12PHE A 157
VAL A 211
PHE A 190
PHE A 163
ALA A 146
None
1.50A20.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3APW_A_DP0A190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
5vzt F-BOX ONLY PROTEIN
31
(Homo
sapiens)
5 / 12TYR B 509
VAL B 344
PHE B 491
PHE B 446
SER B 507
None
None
None
None
DTT  B 602 ( 4.9A)
1.44A17.20
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.
3APW_A_DP0A190_2
(ALPHA-1-ACID
GLYCOPROTEIN 2)
1qg1 PROTEIN (GROWTH
FACTOR RECEPTOR
BINDING PROTEIN)
(Homo
sapiens)
4 / 4VAL E  44
ARG E  94
HIS E  24
PHE E  46
None
1.19A18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3APW_A_DP0A190_2
(ALPHA-1-ACID
GLYCOPROTEIN 2)
1wgr GROWTH FACTOR
RECEPTOR-BOUND
PROTEIN 7
(Homo
sapiens)
4 / 4VAL A  40
ARG A  33
HIS A  34
PHE A  89
None
1.15A17.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3APW_A_DP0A190_2
(ALPHA-1-ACID
GLYCOPROTEIN 2)
2p57 GTPASE-ACTIVATING
PROTEIN ZNF289
(Homo
sapiens)
4 / 4VAL A  58
ARG A  54
HIS A  53
PHE A  62
None
1.49A23.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3APW_A_DP0A190_2
(ALPHA-1-ACID
GLYCOPROTEIN 2)
3apu ALPHA-1-ACID
GLYCOPROTEIN 2
(Homo
sapiens)
4 / 4VAL A  88
ARG A  90
HIS A  97
PHE A 112
None
PG4  A 190 (-4.3A)
None
PG4  A 190 ( 3.9A)
0.28A100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3APW_A_DP0A190_2
(ALPHA-1-ACID
GLYCOPROTEIN 2)
4n78 CYTOPLASMIC
FMR1-INTERACTING
PROTEIN 1
(Homo
sapiens)
4 / 4VAL A 480
ARG A 477
HIS A 474
PHE A 391
None
1.30A9.06
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.
3APW_A_DP0A190_2
(ALPHA-1-ACID
GLYCOPROTEIN 2)
4ykn PHOSPHATIDYLINOSITOL
3-KINASE REGULATORY
SUBUNIT
ALPHA,PHOSPHATIDYLIN
OSITOL
4,5-BISPHOSPHATE
3-KINASE CATALYTIC
SUBUNIT ALPHA
ISOFORM FUSION
PROTEIN
(Homo
sapiens)
4 / 4VAL A1706
ARG A1704
HIS A1701
PHE A1119
None
1.42A8.46
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.
3APW_B_DP0B190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
1h4l CELL DIVISION
PROTEIN KINASE 5
(Homo
sapiens)
5 / 12PHE A  80
LEU A  66
ALA A 148
SER A  47
TYR A  15
None
1.44A21.21
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.
3APW_B_DP0B190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
1hlg LIPASE, GASTRIC
(Homo
sapiens)
5 / 12VAL A 366
ILE A 370
PHE A 176
PHE A 160
ALA A 327
None
1.19A17.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3APW_B_DP0B190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
1pk6 COMPLEMENT C1Q
SUBCOMPONENT, A
CHAIN PRECURSOR
COMPLEMENT C1Q
SUBCOMPONENT, C
CHAIN PRECURSOR
(Homo
sapiens)
5 / 12PHE C 212
LEU C 214
GLN C  91
ALA A  94
PHE A 217
None
1.37A16.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3APW_B_DP0B190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
1rxt GLYCYLPEPTIDE
N-TETRADECANOYLTRANS
FERASE 1
(Homo
sapiens)
5 / 12PHE A 407
PHE A 413
LEU A 411
ALA A 388
PHE A 396
None
1.45A17.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3APW_B_DP0B190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
1skx ORPHAN NUCLEAR
RECEPTOR PXR
(Homo
sapiens)
5 / 12PHE A 369
LEU A 342
ALA A 157
SER A 262
TYR A 263
None
1.38A19.21
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.
3APW_B_DP0B190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
2f5a PROTEIN (ANTIBODY
2F5 (HEAVY CHAIN))
(Homo
sapiens)
5 / 12VAL H  12
ILE H 130
LEU H  65
ARG H  68
TYR H  95
None
1.44A17.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3APW_B_DP0B190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
3a6p EXPORTIN-5
(Homo
sapiens)
5 / 12VAL A 725
ILE A 728
PHE A 862
ALA A 876
PHE A 895
None
1.39A9.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3APW_B_DP0B190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
3apu ALPHA-1-ACID
GLYCOPROTEIN 2
(Homo
sapiens)
12 / 12VAL A  41
ILE A  44
PHE A  49
PHE A  51
LEU A  62
GLU A  64
GLN A  66
ARG A  90
ALA A  99
PHE A 112
SER A 125
TYR A 127
PG4  A 190 (-4.9A)
None
PG4  A 190 ( 4.1A)
None
None
PG4  A 190 (-4.1A)
None
PG4  A 190 (-4.3A)
PG4  A 190 ( 4.2A)
PG4  A 190 ( 3.9A)
PG4  A 190 ( 3.7A)
None
0.66A100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3APW_B_DP0B190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
3ctt MALTASE-GLUCOAMYLASE
(Homo
sapiens)
5 / 12GLU A 658
ARG A 730
ALA A 757
PHE A 735
TYR A 636
None
1.45A12.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3APW_B_DP0B190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
3kq0 ALPHA-1-ACID
GLYCOPROTEIN 1
(Homo
sapiens)
9 / 12VAL A  41
ILE A  44
PHE A  49
PHE A  51
LEU A  62
GLN A  66
ARG A  90
SER A 125
TYR A 127
None
None
JIM  A 193 (-3.8A)
None
None
None
JIM  A 193 (-4.3A)
None
None
0.74A86.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3APW_B_DP0B190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
3kq0 ALPHA-1-ACID
GLYCOPROTEIN 1
(Homo
sapiens)
10 / 12VAL A  41
ILE A  44
PHE A  49
PHE A  51
LEU A  62
GLU A  64
ARG A  90
ALA A  99
SER A 125
TYR A 127
None
None
JIM  A 193 (-3.8A)
None
None
None
JIM  A 193 (-4.3A)
JIM  A 193 ( 4.0A)
None
None
0.64A86.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3APW_B_DP0B190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
4is8 NUCLEAR RECEPTOR
SUBFAMILY 5 GROUP A
MEMBER 2
(Homo
sapiens)
5 / 12VAL A 318
ILE A 322
LEU A 531
GLN A 351
ALA A 360
None
1.14A20.97
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.
3APW_B_DP0B190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
4xq7 2'-5'-OLIGOADENYLATE
SYNTHASE-LIKE
PROTEIN
(Homo
sapiens)
5 / 12PHE A 191
ALA A 180
PHE A  94
SER A  93
TYR A 157
CME  A 188 ( 4.4A)
None
CME  A 188 ( 3.6A)
None
None
1.33A19.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3APW_B_DP0B190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
5hkj COMPLEMENT C1Q
SUBCOMPONENT SUBUNIT
A,COMPLEMENT C1Q
SUBCOMPONENT SUBUNIT
C,COMPLEMENT C1Q
SUBCOMPONENT SUBUNIT
B
(Homo
sapiens)
5 / 12PHE A 265
LEU A 267
GLN A 144
ALA A   7
PHE A 130
None
1.31A15.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3APW_B_DP0B190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
6ez8 HUNTINGTIN
(Homo
sapiens)
5 / 12VAL A 746
ILE A 749
PHE A 380
LEU A 376
SER A 725
None
1.36A13.66