gh #495 Output - PAIN-CKB

We use cookies to improve your website experience and to gain insights into our websites' users, traffic and traffic providers to make it even better. You consent to our cookies if you continue to use our website.

gh #495 Output Download CSV

View Paged

Gene Protein

The docking scores are in the AutoDock Vina metric.

5HT1B_HUMAN

Docking Scores:
-7.39 -8.03 -8.13
Similarity Score:
30.19%
Best Match:
CHEMBL321190

5HT2A_HUMAN

Docking Scores:
-8.22 -8.62
Similarity Score:
33.33%
Best Match:
CHEMBL221753

5HT2B_HUMAN

Docking Scores:
-8.08 -8.11 -8.24
Similarity Score:
33.10%
Best Match:
CHEMBL3817898

5HT2C_HUMAN

Docking Scores:
-7.75 -8.14
Similarity Score:
33.33%
Best Match:
CHEMBL221753

AA1R_HUMAN

Docking Scores:
-7.46 -8.12 -5.12
Similarity Score:
33.14%
Best Match:
CHEMBL1269107

AA2AR_HUMAN

Docking Scores:
-7.89 -7.86 -6.76
Similarity Score:
26.76%
Best Match:
CHEMBL2042091

ACES_HUMAN

Docking Scores:
-9.28 -8.23 -8.97
Similarity Score:
45.67%
Best Match:
CHEMBL3586200

ACE_HUMAN

Docking Scores:
-8.51 -8.51 -7.43
Similarity Score:
34.73%
Best Match:
CHEMBL172801

ACHA9_HUMAN

Docking Scores:
-6.49
Similarity Score:
18.47%
Best Match:
CHEMBL386114

ACHB2_HUMAN

Docking Scores:
-4.96 -6.03 -3.78
Similarity Score:
N/A
Best Match:
N/A

ACM1_HUMAN

Docking Scores:
-9.30 0.40
Similarity Score:
34.31%
Best Match:
CHEMBL1101

ACM4_HUMAN

Docking Scores:
-8.72 -5.30
Similarity Score:
34.31%
Best Match:
CHEMBL1101

ADRB2_HUMAN

Docking Scores:
-8.01 -7.10 -8.11
Similarity Score:
31.30%
Best Match:
CHEMBL1714856

AGTR2_HUMAN

Docking Scores:
-7.63 -7.94 -7.62
Similarity Score:
28.86%
Best Match:
CHEMBL154057

ALDR_HUMAN

Docking Scores:
-8.14 -8.01 -9.78
Similarity Score:
35.57%
Best Match:
CHEMBL69646

AMPN_HUMAN

Docking Scores:
-7.59 -7.71 -7.47
Similarity Score:
29.12%
Best Match:
CHEMBL1782887

AOFA_HUMAN

Docking Scores:
-8.81 -9.79 -8.31
Similarity Score:
38.32%
Best Match:
CHEMBL1070

AOFB_HUMAN

Docking Scores:
-9.35 -8.93 -9.33
Similarity Score:
36.09%
Best Match:
CHEMBL3288305

BACE1_HUMAN

Docking Scores:
-7.03 -7.31 -7.90
Similarity Score:
37.50%
Best Match:
CHEMBL243796

CAH2_HUMAN

Docking Scores:
-6.94 -7.78 -7.72
Similarity Score:
43.22%
Best Match:
CHEMBL4068228

CASP1_HUMAN

Docking Scores:
-5.85 -7.78 -5.98
Similarity Score:
40.00%
Best Match:
CHEMBL400514

CDK5_HUMAN

Docking Scores:
-6.82 -6.48 -6.43
Similarity Score:
24.66%
Best Match:
CHEMBL2000879

CHLE_HUMAN

Docking Scores:
-8.50 -8.24 -8.32
Similarity Score:
45.67%
Best Match:
CHEMBL3586200

CNR1_HUMAN

Docking Scores:
-6.95 -8.03 -8.31
Similarity Score:
44.08%
Best Match:
CHEMBL456341

CNR2_HUMAN

Docking Scores:
-7.30 -8.54
Similarity Score:
44.08%
Best Match:
CHEMBL320408

COLI_HUMAN

Docking Scores:
-7.42 -7.16 -6.23
Similarity Score:
N/A
Best Match:
N/A

COMT_HUMAN

Docking Scores:
-5.86 -5.93 -6.10
Similarity Score:
21.84%
Best Match:
CHEMBL4639358

CRP_HUMAN

Docking Scores:
-5.86 -5.86
Similarity Score:
N/A
Best Match:
N/A

CXCR1_HUMAN

Docking Scores:
-2.16
Similarity Score:
24.22%
Best Match:
CHEMBL220182

CXCR4_HUMAN

Docking Scores:
-7.72 -7.57 -7.09
Similarity Score:
28.57%
Best Match:
CHEMBL4440964

DRD2_HUMAN

Docking Scores:
-7.97
Similarity Score:
34.78%
Best Match:
CHEMBL292186

DRD3_HUMAN

Docking Scores:
-7.99
Similarity Score:
40.14%
Best Match:
CHEMBL4100634

DRD4_HUMAN

Docking Scores:
-7.96 -7.85
Similarity Score:
36.03%
Best Match:
CHEMBL61090

EDN1_HUMAN

Docking Scores:
-6.96
Similarity Score:
N/A
Best Match:
N/A

ESR1_HUMAN

Docking Scores:
-6.41 -7.46 -7.56
Similarity Score:
46.90%
Best Match:
CHEMBL57150

FABP5_HUMAN

Docking Scores:
-8.37 -5.36 -5.70
Similarity Score:
40.00%
Best Match:
CHEMBL4292072

FYN_HUMAN

Docking Scores:
-7.43
Similarity Score:
33.33%
Best Match:
CHEMBL221753

GLRA3_HUMAN

Docking Scores:
-8.84 -8.61 -8.86
Similarity Score:
19.84%
Best Match:
CHEMBL4070615

GLRA3_HUMAN

Docking Scores:
-8.62
Similarity Score:
19.84%
Best Match:
CHEMBL4070615

GRM5_HUMAN

Docking Scores:
-6.66 -5.01 -5.12
Similarity Score:
31.21%
Best Match:
CHEMBL1348198

HPGDS_HUMAN

Docking Scores:
-7.82 -7.28 -6.50
Similarity Score:
26.87%
Best Match:
CHEMBL1743209

HRH1_HUMAN

Docking Scores:
-5.23
Similarity Score:
36.57%
Best Match:
CHEMBL59798

HYES_HUMAN

Docking Scores:
-8.30 -7.86 -7.63
Similarity Score:
36.99%
Best Match:
CHEMBL3764398

IKKB_HUMAN

Docking Scores:
-6.10
Similarity Score:
40.94%
Best Match:
CHEMBL3318173

MDR1_HUMAN

Docking Scores:
-8.04 -7.65
Similarity Score:
54.91%
Best Match:
CHEMBL1

MIF_HUMAN

Docking Scores:
-6.36 -7.19 -6.68
Similarity Score:
38.60%
Best Match:
CHEMBL2375653

MK01_HUMAN

Docking Scores:
-5.99 -6.95 -6.78
Similarity Score:
40.00%
Best Match:
CHEMBL2012519

MK03_HUMAN

Docking Scores:
-6.15 -6.83 -7.08
Similarity Score:
39.25%
Best Match:
CHEMBL555017

MTOR_HUMAN

Docking Scores:
-8.08 -8.31 -8.64
Similarity Score:
35.17%
Best Match:
CHEMBL1797428

NEP_HUMAN

Docking Scores:
-7.58 -7.32 -7.45
Similarity Score:
34.65%
Best Match:
CHEMBL4096514

NK1R_HUMAN

Docking Scores:
-7.63 -6.83 -7.08
Similarity Score:
39.44%
Best Match:
CHEMBL1817892

NMDE1_HUMAN

Docking Scores:
-7.30 -6.87 -7.21
Similarity Score:
19.46%
Best Match:
CHEMBL284237

NMDE2_HUMAN

Docking Scores:
-8.09 -8.33 -7.24
Similarity Score:
33.10%
Best Match:
CHEMBL4294561

NMDZ1_HUMAN

Docking Scores:
-7.33 -6.95 -7.21
Similarity Score:
20.44%
Best Match:
CHEMBL162577

NOS1_HUMAN

Docking Scores:
-7.79 -7.78 -6.89
Similarity Score:
27.78%
Best Match:
CHEMBL85823

NOS2_HUMAN

Docking Scores:
-6.70 -7.07 -6.07
Similarity Score:
27.92%
Best Match:
CHEMBL1762477

NTRK1_HUMAN

Docking Scores:
-8.75 -7.08 -8.37
Similarity Score:
38.36%
Best Match:
CHEMBL444109

OPRD_HUMAN

Docking Scores:
-7.13 -6.38 -6.65
Similarity Score:
44.30%
Best Match:
CHEMBL1161423

OPRK_HUMAN

Docking Scores:
-8.53 -8.13 -8.04
Similarity Score:
39.61%
Best Match:
CHEMBL177957

OPRM_MOUSE

Docking Scores:
-8.12 -7.86
Similarity Score:
31.96%
Best Match:
CHEMBL299031

OPRX_HUMAN

Docking Scores:
-7.26 -7.36 -7.15
Similarity Score:
34.92%
Best Match:
CHEMBL3919659

P2RX3_HUMAN

Docking Scores:
-5.56 -5.47 -6.06
Similarity Score:
36.77%
Best Match:
CHEMBL290814

P2Y12_HUMAN

Docking Scores:
-6.89 -7.29 -7.28
Similarity Score:
26.11%
Best Match:
CHEMBL420980

PAR1_HUMAN

Docking Scores:
-6.69
Similarity Score:
35.00%
Best Match:
CHEMBL234690

PDE4B_HUMAN

Docking Scores:
-7.74 -7.75 -8.38
Similarity Score:
40.44%
Best Match:
CHEMBL511115

PDE5A_HUMAN

Docking Scores:
-7.98 -7.47 -7.50
Similarity Score:
32.52%
Best Match:
CHEMBL190423

PERM_HUMAN

Docking Scores:
-7.48 -7.56 -7.51
Similarity Score:
26.36%
Best Match:
CHEMBL3920217

PGH1_SHEEP

Docking Scores:
-5.93 -7.56 -5.95
Similarity Score:
34.38%
Best Match:
CHEMBL3400659

PGH2_HUMAN

Docking Scores:
-1.30 -6.23 -6.73
Similarity Score:
37.50%
Best Match:
CHEMBL374130

PPAP_HUMAN

Docking Scores:
-7.54 -7.85
Similarity Score:
23.18%
Best Match:
CHEMBL507996

PPARG_HUMAN

Docking Scores:
-7.59 -8.01 -8.49
Similarity Score:
44.44%
Best Match:
CHEMBL4460072

PRGR_HUMAN

Docking Scores:
-7.24 -6.65 -8.52
Similarity Score:
54.81%
Best Match:
CHEMBL221686

PTGES_HUMAN

Docking Scores:
-6.82
Similarity Score:
47.55%
Best Match:
CHEMBL445599

SC6A4_HUMAN

Docking Scores:
-8.63 -8.89 -9.05
Similarity Score:
40.65%
Best Match:
CHEMBL1201151

SCN9A_HUMAN

Docking Scores:
-7.27
Similarity Score:
41.01%
Best Match:
CHEMBL203185

TLR4_HUMAN

Docking Scores:
-7.49 -7.15 -7.52
Similarity Score:
33.13%
Best Match:
CHEMBL4071705

TNFA_HUMAN

Docking Scores:
-7.30 -7.40 -5.56
Similarity Score:
34.60%
Best Match:
CHEMBL2337623

TRBM_HUMAN

Docking Scores:
-6.51 -7.18
Similarity Score:
N/A
Best Match:
N/A

TRPM4_HUMAN

Docking Scores:
-7.03 -6.41
Similarity Score:
17.24%
Best Match:
CHEMBL1408302

TRPM8_FICAL

Docking Scores:
-8.54
Similarity Score:
N/A
Best Match:
N/A

TRPV1_RAT

Docking Scores:
-6.89
Similarity Score:
42.68%
Best Match:
CHEMBL104647

TRPV2_RABIT

Docking Scores:
-8.16 -8.09
Similarity Score:
N/A
Best Match:
N/A

TRPV3_HUMAN

Docking Scores:
-6.22 -5.92
Similarity Score:
32.77%
Best Match:
CHEMBL3664218

TRXR1_HUMAN

Docking Scores:
-7.81 -7.69 -6.19
Similarity Score:
22.47%
Best Match:
CHEMBL4459518

TRY1_HUMAN

Docking Scores:
-5.77
Similarity Score:
36.44%
Best Match:
CHEMBL101030