Jin's drug 02 #273 Output - PAIN-CKB

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Jin's drug 02 #273 Output Download CSV

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Gene Protein

The docking scores are in the AutoDock Vina metric.

5HT1B_HUMAN

Docking Scores:
-10.46 -11.84 -10.68
Similarity Score:
45.14%
Best Match:
CHEMBL119800

5HT2A_HUMAN

Docking Scores:
-11.53 -11.44
Similarity Score:
53.79%
Best Match:
CHEMBL3600976

5HT2B_HUMAN

Docking Scores:
-10.53 -11.21 -10.71
Similarity Score:
43.53%
Best Match:
CHEMBL212064

5HT2C_HUMAN

Docking Scores:
-11.19 -12.00
Similarity Score:
44.12%
Best Match:
CHEMBL18786

AA1R_HUMAN

Docking Scores:
-10.28 -9.74 -9.35
Similarity Score:
34.51%
Best Match:
CHEMBL3965184

AA2AR_HUMAN

Docking Scores:
-9.91 -9.57 -9.75
Similarity Score:
34.51%
Best Match:
CHEMBL3965184

ACES_HUMAN

Docking Scores:
-9.37 -11.12 -9.94
Similarity Score:
41.61%
Best Match:
CHEMBL4080105

ACE_HUMAN

Docking Scores:
-10.05 -10.15 -6.69
Similarity Score:
28.93%
Best Match:
CHEMBL98

ACHA9_HUMAN

Docking Scores:
-8.47
Similarity Score:
15.70%
Best Match:
CHEMBL386114

ACHB2_HUMAN

Docking Scores:
-4.88 -5.65 -5.78
Similarity Score:
N/A
Best Match:
N/A

ACM1_HUMAN

Docking Scores:
-4.20 4.53
Similarity Score:
53.79%
Best Match:
CHEMBL3600976

ACM4_HUMAN

Docking Scores:
-8.80 -8.96
Similarity Score:
31.87%
Best Match:
CHEMBL543177

ADRB2_HUMAN

Docking Scores:
-10.61 -10.99 -11.83
Similarity Score:
46.46%
Best Match:
CHEMBL270964

AGTR2_HUMAN

Docking Scores:
-10.05 -9.80 -10.03
Similarity Score:
30.77%
Best Match:
CHEMBL2435834

ALDR_HUMAN

Docking Scores:
-10.59 -11.30 -11.50
Similarity Score:
31.76%
Best Match:
CHEMBL2260153

AMPN_HUMAN

Docking Scores:
-10.33 -9.87 -9.68
Similarity Score:
28.97%
Best Match:
CHEMBL3764919

AOFA_HUMAN

Docking Scores:
-11.59 -11.64 -11.41
Similarity Score:
45.11%
Best Match:
CHEMBL466872

AOFB_HUMAN

Docking Scores:
-12.39 -12.29 -12.42
Similarity Score:
62.96%
Best Match:
CHEMBL3613273

BACE1_HUMAN

Docking Scores:
-8.24 -9.41 -9.44
Similarity Score:
36.36%
Best Match:
CHEMBL370043

CAH2_HUMAN

Docking Scores:
-8.87 -8.65 -8.86
Similarity Score:
57.72%
Best Match:
CHEMBL4081738

CASP1_HUMAN

Docking Scores:
-7.74 -8.44 -8.08
Similarity Score:
34.86%
Best Match:
CHEMBL237310

CDK5_HUMAN

Docking Scores:
-9.63 -9.31 -10.46
Similarity Score:
44.14%
Best Match:
CHEMBL1996176

CHLE_HUMAN

Docking Scores:
-9.26 -9.29 -9.60
Similarity Score:
37.40%
Best Match:
CHEMBL2381400

CNR1_HUMAN

Docking Scores:
-10.07 -9.66 -10.03
Similarity Score:
36.91%
Best Match:
CHEMBL579194

CNR2_HUMAN

Docking Scores:
-10.38 -10.44
Similarity Score:
48.80%
Best Match:
CHEMBL2338171

COLI_HUMAN

Docking Scores:
-10.50 -10.11 -9.62
Similarity Score:
N/A
Best Match:
N/A

COMT_HUMAN

Docking Scores:
-6.97 -7.60 -7.40
Similarity Score:
31.41%
Best Match:
CHEMBL953

CRP_HUMAN

Docking Scores:
-6.54 -6.82
Similarity Score:
N/A
Best Match:
N/A

CXCR1_HUMAN

Docking Scores:
-3.65
Similarity Score:
30.06%
Best Match:
CHEMBL464302

CXCR4_HUMAN

Docking Scores:
-9.63 -8.19 -8.75
Similarity Score:
24.40%
Best Match:
CHEMBL3779982

DRD2_HUMAN

Docking Scores:
-10.09
Similarity Score:
45.83%
Best Match:
CHEMBL415520

DRD3_HUMAN

Docking Scores:
-10.74
Similarity Score:
45.83%
Best Match:
CHEMBL415520

DRD4_HUMAN

Docking Scores:
-10.55 -10.48
Similarity Score:
38.36%
Best Match:
CHEMBL338606

EDN1_HUMAN

Docking Scores:
-9.00
Similarity Score:
N/A
Best Match:
N/A

ESR1_HUMAN

Docking Scores:
-10.33 -9.74 -9.85
Similarity Score:
42.28%
Best Match:
CHEMBL3621988

FABP5_HUMAN

Docking Scores:
-7.27 -7.39 -7.84
Similarity Score:
36.00%
Best Match:
CHEMBL3950316

FYN_HUMAN

Docking Scores:
-10.16
Similarity Score:
45.16%
Best Match:
CHEMBL2002702

GLRA3_HUMAN

Docking Scores:
-9.23 -9.62 -9.58
Similarity Score:
16.10%
Best Match:
CHEMBL4074873

GLRA3_HUMAN

Docking Scores:
-9.90
Similarity Score:
16.10%
Best Match:
CHEMBL4074873

GRM5_HUMAN

Docking Scores:
-7.97 -6.37 -6.55
Similarity Score:
34.87%
Best Match:
CHEMBL239594

HPGDS_HUMAN

Docking Scores:
-9.32 -9.66 -10.27
Similarity Score:
34.52%
Best Match:
CHEMBL3698258

HRH1_HUMAN

Docking Scores:
-10.73
Similarity Score:
35.57%
Best Match:
CHEMBL2158822

HYES_HUMAN

Docking Scores:
-9.67 -9.71 -10.17
Similarity Score:
42.65%
Best Match:
CHEMBL4060303

IKKB_HUMAN

Docking Scores:
-9.76
Similarity Score:
35.22%
Best Match:
CHEMBL1082834

MDR1_HUMAN

Docking Scores:
-10.16 -10.70
Similarity Score:
43.45%
Best Match:
CHEMBL3613020

MIF_HUMAN

Docking Scores:
-5.85 -8.20 -8.18
Similarity Score:
34.72%
Best Match:
CHEMBL1604170

MK01_HUMAN

Docking Scores:
-11.02 -8.64 -9.16
Similarity Score:
38.51%
Best Match:
CHEMBL2002649

MK03_HUMAN

Docking Scores:
-9.81 -10.33 -9.55
Similarity Score:
35.61%
Best Match:
CHEMBL3577637

MTOR_HUMAN

Docking Scores:
-10.68 -10.93 -11.00
Similarity Score:
38.10%
Best Match:
CHEMBL3735791

NEP_HUMAN

Docking Scores:
-9.35 -9.31 -10.33
Similarity Score:
35.88%
Best Match:
CHEMBL81232

NK1R_HUMAN

Docking Scores:
-9.44 -9.96 -10.11
Similarity Score:
46.04%
Best Match:
CHEMBL303119

NMDE1_HUMAN

Docking Scores:
-12.07 -10.40 -10.20
Similarity Score:
16.09%
Best Match:
CHEMBL2333945

NMDE2_HUMAN

Docking Scores:
-10.88 -10.17 -12.05
Similarity Score:
30.25%
Best Match:
CHEMBL158874

NMDZ1_HUMAN

Docking Scores:
-12.02 -10.44 -10.20
Similarity Score:
26.92%
Best Match:
CHEMBL162293

NOS1_HUMAN

Docking Scores:
-9.35 -9.62 -9.76
Similarity Score:
30.63%
Best Match:
CHEMBL542431

NOS2_HUMAN

Docking Scores:
-5.44 -9.74 28.84
Similarity Score:
27.68%
Best Match:
CHEMBL491570

NTRK1_HUMAN

Docking Scores:
-10.61 -11.03 -11.28
Similarity Score:
47.47%
Best Match:
CHEMBL1980329

OPRD_HUMAN

Docking Scores:
-9.32 -5.40 -8.28
Similarity Score:
37.41%
Best Match:
CHEMBL1939743

OPRK_HUMAN

Docking Scores:
-10.08 -9.48 -9.92
Similarity Score:
39.44%
Best Match:
CHEMBL4097541

OPRM_MOUSE

Docking Scores:
-9.13 -9.19
Similarity Score:
38.35%
Best Match:
CHEMBL283552

OPRX_HUMAN

Docking Scores:
-8.78 -8.84 -9.12
Similarity Score:
32.90%
Best Match:
CHEMBL198600

P2RX3_HUMAN

Docking Scores:
-7.27 -6.99 -6.83
Similarity Score:
31.32%
Best Match:
CHEMBL3669699

P2Y12_HUMAN

Docking Scores:
-11.53 -6.68 -9.43
Similarity Score:
32.99%
Best Match:
CHEMBL557553

PAR1_HUMAN

Docking Scores:
-10.21
Similarity Score:
36.41%
Best Match:
CHEMBL3109574

PDE4B_HUMAN

Docking Scores:
-9.93 -9.50 -9.66
Similarity Score:
35.93%
Best Match:
CHEMBL371089

PDE5A_HUMAN

Docking Scores:
-9.46 -10.17 -9.96
Similarity Score:
35.67%
Best Match:
CHEMBL42869

PERM_HUMAN

Docking Scores:
-8.77 -9.04 -9.25
Similarity Score:
42.73%
Best Match:
CHEMBL686

PGH1_SHEEP

Docking Scores:
-10.08 -8.19 -10.01
Similarity Score:
38.28%
Best Match:
CHEMBL9254

PGH2_HUMAN

Docking Scores:
3.23 -10.77 -9.89
Similarity Score:
47.75%
Best Match:
CHEMBL23588

PPAP_HUMAN

Docking Scores:
-9.36
Similarity Score:
13.38%
Best Match:
CHEMBL498632

PPARG_HUMAN

Docking Scores:
-9.37 -10.26 -9.06
Similarity Score:
44.37%
Best Match:
CHEMBL118852

PRGR_HUMAN

Docking Scores:
0.93 -0.32 -5.86
Similarity Score:
51.22%
Best Match:
CHEMBL93463

PTGES_HUMAN

Docking Scores:
-9.24
Similarity Score:
41.18%
Best Match:
CHEMBL1086884

SC6A4_HUMAN

Docking Scores:
-10.46 -10.51 -10.21
Similarity Score:
36.99%
Best Match:
CHEMBL575699

SCN9A_HUMAN

Docking Scores:
-8.62
Similarity Score:
42.86%
Best Match:
CHEMBL3576950

TLR4_HUMAN

Docking Scores:
-10.29 -10.27 -10.30
Similarity Score:
29.71%
Best Match:
CHEMBL1223752

TNFA_HUMAN

Docking Scores:
-8.37
Similarity Score:
33.33%
Best Match:
CHEMBL1569174

TRBM_HUMAN

Docking Scores:
-8.76 -8.09
Similarity Score:
N/A
Best Match:
N/A

TRPM4_HUMAN

Docking Scores:
-8.88 -7.69
Similarity Score:
N/A
Best Match:
N/A

TRPM8_FICAL

Docking Scores:
-11.05
Similarity Score:
N/A
Best Match:
N/A

TRPV1_RAT

Docking Scores:
-9.83
Similarity Score:
43.97%
Best Match:
CHEMBL195789

TRPV2_RABIT

Docking Scores:
-8.73 -9.38
Similarity Score:
N/A
Best Match:
N/A

TRPV3_HUMAN

Docking Scores:
-8.87 -7.71
Similarity Score:
26.84%
Best Match:
CHEMBL3910757

TRXR1_HUMAN

Docking Scores:
-8.77 -9.72 -7.11
Similarity Score:
N/A
Best Match:
N/A

TRY1_HUMAN

Docking Scores:
-7.18
Similarity Score:
45.45%
Best Match:
CHEMBL99630