lUSOP MedTEC-586-23 #322 Output - PAIN-CKB

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lUSOP MedTEC-586-23 #322 Output Download CSV

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Gene Protein

The docking scores are in the AutoDock Vina metric.

5HT1B_HUMAN

Docking Scores:
-9.27 -8.94 -8.39
Similarity Score:
33.46%
Best Match:
CHEMBL1632218

5HT2A_HUMAN

Docking Scores:
-9.56 -8.18
Similarity Score:
39.76%
Best Match:
CHEMBL3899099

5HT2B_HUMAN

Docking Scores:
-8.99 -9.00 -8.90
Similarity Score:
39.76%
Best Match:
CHEMBL3899099

5HT2C_HUMAN

Docking Scores:
-9.11 -9.36
Similarity Score:
39.93%
Best Match:
CHEMBL4098357

AA1R_HUMAN

Docking Scores:
-8.56 -8.39 -7.22
Similarity Score:
32.09%
Best Match:
CHEMBL3234963

AA2AR_HUMAN

Docking Scores:
-8.71 -8.70 -8.29
Similarity Score:
36.13%
Best Match:
CHEMBL601413

ACES_HUMAN

Docking Scores:
-10.10 -9.40 -6.24
Similarity Score:
42.03%
Best Match:
CHEMBL3343928

ACE_HUMAN

Docking Scores:
-8.70 -8.25 -6.32
Similarity Score:
36.84%
Best Match:
CHEMBL148616

ACHA9_HUMAN

Docking Scores:
-6.87
Similarity Score:
29.51%
Best Match:
CHEMBL386114

ACHB2_HUMAN

Docking Scores:
-5.55 -7.51 -5.06
Similarity Score:
N/A
Best Match:
N/A

ACM1_HUMAN

Docking Scores:
-8.40 -0.40
Similarity Score:
36.59%
Best Match:
CHEMBL2206597

ACM4_HUMAN

Docking Scores:
-8.58 -7.18
Similarity Score:
36.77%
Best Match:
CHEMBL2313397

ADRB2_HUMAN

Docking Scores:
-7.39 -8.62 -9.26
Similarity Score:
37.98%
Best Match:
CHEMBL419085

AGTR2_HUMAN

Docking Scores:
-8.97 -8.87 -8.61
Similarity Score:
37.68%
Best Match:
CHEMBL339544

ALDR_HUMAN

Docking Scores:
-8.69 -8.00 -8.83
Similarity Score:
41.36%
Best Match:
CHEMBL20685

AMPN_HUMAN

Docking Scores:
-8.02 -8.40 -8.16
Similarity Score:
38.41%
Best Match:
CHEMBL1077591

AOFA_HUMAN

Docking Scores:
-9.82 -8.94 -9.45
Similarity Score:
28.19%
Best Match:
CHEMBL3310020

AOFB_HUMAN

Docking Scores:
-9.94 -9.20 -8.37
Similarity Score:
29.43%
Best Match:
CHEMBL3093174

BACE1_HUMAN

Docking Scores:
-6.67 -7.36 -8.01
Similarity Score:
54.89%
Best Match:
CHEMBL3639931

CAH2_HUMAN

Docking Scores:
-7.65 -7.85 -7.44
Similarity Score:
36.80%
Best Match:
CHEMBL50045

CASP1_HUMAN

Docking Scores:
-6.48 -7.04 -6.51
Similarity Score:
35.28%
Best Match:
CHEMBL181768

CDK5_HUMAN

Docking Scores:
-7.50 -8.09 -7.31
Similarity Score:
31.72%
Best Match:
CHEMBL1989043

CHLE_HUMAN

Docking Scores:
-9.25 -9.33 -9.50
Similarity Score:
40.65%
Best Match:
CHEMBL4078849

CNR1_HUMAN

Docking Scores:
-7.63 -9.16 -10.15
Similarity Score:
46.59%
Best Match:
CHEMBL3985937

CNR2_HUMAN

Docking Scores:
-9.61 -9.96
Similarity Score:
53.60%
Best Match:
CHEMBL3939093

COLI_HUMAN

Docking Scores:
-7.80 -7.91 -8.15
Similarity Score:
N/A
Best Match:
N/A

COMT_HUMAN

Docking Scores:
-5.78 -6.33 -5.94
Similarity Score:
31.15%
Best Match:
CHEMBL3819488

CRP_HUMAN

Docking Scores:
-5.70 -5.84
Similarity Score:
N/A
Best Match:
N/A

CXCR1_HUMAN

Docking Scores:
-2.86
Similarity Score:
41.03%
Best Match:
CHEMBL401893

CXCR4_HUMAN

Docking Scores:
-8.59 -6.99 -7.97
Similarity Score:
40.56%
Best Match:
CHEMBL3627794

DRD2_HUMAN

Docking Scores:
-7.85
Similarity Score:
54.44%
Best Match:
CHEMBL2152746

DRD3_HUMAN

Docking Scores:
-8.50
Similarity Score:
54.44%
Best Match:
CHEMBL2152746

DRD4_HUMAN

Docking Scores:
-9.58 -10.00
Similarity Score:
38.93%
Best Match:
CHEMBL301265

EDN1_HUMAN

Docking Scores:
-8.75
Similarity Score:
N/A
Best Match:
N/A

ESR1_HUMAN

Docking Scores:
-7.51 -7.78 -7.77
Similarity Score:
34.73%
Best Match:
CHEMBL434502

FABP5_HUMAN

Docking Scores:
-8.06 -6.02 -5.64
Similarity Score:
29.64%
Best Match:
CHEMBL3890665

FYN_HUMAN

Docking Scores:
-8.65
Similarity Score:
32.63%
Best Match:
CHEMBL3622137

GLRA3_HUMAN

Docking Scores:
-8.16 -8.72 -8.50
Similarity Score:
26.48%
Best Match:
CHEMBL4070615

GLRA3_HUMAN

Docking Scores:
-8.20
Similarity Score:
26.48%
Best Match:
CHEMBL4070615

GRM5_HUMAN

Docking Scores:
-6.36 -5.91 -5.74
Similarity Score:
43.06%
Best Match:
CHEMBL3672914

HPGDS_HUMAN

Docking Scores:
-7.98 -7.54 -7.83
Similarity Score:
32.58%
Best Match:
CHEMBL3650217

HRH1_HUMAN

Docking Scores:
-6.51
Similarity Score:
39.76%
Best Match:
CHEMBL3899099

HYES_HUMAN

Docking Scores:
-7.94 -8.64 -8.54
Similarity Score:
30.77%
Best Match:
CHEMBL589133

IKKB_HUMAN

Docking Scores:
-8.55
Similarity Score:
31.11%
Best Match:
CHEMBL492755

MDR1_HUMAN

Docking Scores:
-8.81 -8.70
Similarity Score:
47.37%
Best Match:
CHEMBL4077753

MIF_HUMAN

Docking Scores:
-6.90 -6.66 -6.16
Similarity Score:
22.03%
Best Match:
CHEMBL554271

MK01_HUMAN

Docking Scores:
-7.70 -7.54 -8.05
Similarity Score:
41.67%
Best Match:
CHEMBL3919801

MK03_HUMAN

Docking Scores:
-8.30 -9.12 -8.38
Similarity Score:
30.52%
Best Match:
CHEMBL213618

MTOR_HUMAN

Docking Scores:
-8.90 -9.35 -9.76
Similarity Score:
36.31%
Best Match:
CHEMBL2334767

NEP_HUMAN

Docking Scores:
-7.49 -6.96 -7.91
Similarity Score:
31.34%
Best Match:
CHEMBL198316

NK1R_HUMAN

Docking Scores:
-8.05 -8.62 -8.49
Similarity Score:
39.41%
Best Match:
CHEMBL1766208

NMDE1_HUMAN

Docking Scores:
-8.66 -7.57 -8.17
Similarity Score:
18.73%
Best Match:
CHEMBL2333945

NMDE2_HUMAN

Docking Scores:
-9.43 -9.17 -8.62
Similarity Score:
25.41%
Best Match:
CHEMBL444384

NMDZ1_HUMAN

Docking Scores:
-8.51 -8.39 -8.17
Similarity Score:
34.53%
Best Match:
CHEMBL354003

NOS1_HUMAN

Docking Scores:
-8.20 -8.17 -7.89
Similarity Score:
34.04%
Best Match:
CHEMBL489724

NOS2_HUMAN

Docking Scores:
-8.16 -8.01 -1.68
Similarity Score:
34.70%
Best Match:
CHEMBL491723

NTRK1_HUMAN

Docking Scores:
-8.35 -8.57 -8.47
Similarity Score:
37.16%
Best Match:
CHEMBL3666420

OPRD_HUMAN

Docking Scores:
-7.62 -6.67 -7.73
Similarity Score:
40.00%
Best Match:
CHEMBL605735

OPRK_HUMAN

Docking Scores:
-9.52 -8.61 -8.89
Similarity Score:
41.74%
Best Match:
CHEMBL1412078

OPRM_MOUSE

Docking Scores:
-8.45 -8.09
Similarity Score:
36.86%
Best Match:
CHEMBL316863

OPRX_HUMAN

Docking Scores:
-7.79 -8.12 -8.03
Similarity Score:
38.25%
Best Match:
CHEMBL511373

P2RX3_HUMAN

Docking Scores:
-5.73 -5.71 -5.97
Similarity Score:
39.46%
Best Match:
CHEMBL3679841

P2Y12_HUMAN

Docking Scores:
-8.24 -7.37 -9.34
Similarity Score:
34.01%
Best Match:
CHEMBL3322647

PAR1_HUMAN

Docking Scores:
-7.20
Similarity Score:
37.17%
Best Match:
CHEMBL68372

PDE4B_HUMAN

Docking Scores:
-8.06 -7.93 -8.35
Similarity Score:
41.39%
Best Match:
CHEMBL3288016

PDE5A_HUMAN

Docking Scores:
-7.87 -9.27 -8.06
Similarity Score:
43.12%
Best Match:
CHEMBL1650876

PERM_HUMAN

Docking Scores:
-7.92 -8.09 -7.97
Similarity Score:
27.00%
Best Match:
CHEMBL86

PGH1_SHEEP

Docking Scores:
-7.60 -7.34 -5.95
Similarity Score:
32.30%
Best Match:
CHEMBL9191

PGH2_HUMAN

Docking Scores:
-1.70 -8.33 -7.09
Similarity Score:
38.57%
Best Match:
CHEMBL27875

PPAP_HUMAN

Docking Scores:
-7.40
Similarity Score:
14.73%
Best Match:
CHEMBL507996

PPARG_HUMAN

Docking Scores:
-8.53 -8.72 -8.07
Similarity Score:
36.28%
Best Match:
CHEMBL1778840

PRGR_HUMAN

Docking Scores:
0.93 2.03 -8.02
Similarity Score:
38.71%
Best Match:
CHEMBL551782

PTGES_HUMAN

Docking Scores:
-7.67
Similarity Score:
41.59%
Best Match:
CHEMBL3660831

SC6A4_HUMAN

Docking Scores:
-9.56 -9.34 -9.50
Similarity Score:
43.30%
Best Match:
CHEMBL3128180

SCN9A_HUMAN

Docking Scores:
-7.89
Similarity Score:
40.00%
Best Match:
CHEMBL3960184

TLR4_HUMAN

Docking Scores:
-8.10 -7.52 -7.76
Similarity Score:
20.07%
Best Match:
CHEMBL1223751

TNFA_HUMAN

Docking Scores:
-7.54
Similarity Score:
35.31%
Best Match:
CHEMBL3806135

TRBM_HUMAN

Docking Scores:
-8.55 -7.23
Similarity Score:
N/A
Best Match:
N/A

TRPM4_HUMAN

Docking Scores:
-7.64 -6.38
Similarity Score:
N/A
Best Match:
N/A

TRPM8_FICAL

Docking Scores:
-9.22
Similarity Score:
N/A
Best Match:
N/A

TRPV1_RAT

Docking Scores:
-8.81
Similarity Score:
34.93%
Best Match:
CHEMBL438345

TRPV2_RABIT

Docking Scores:
-7.23 -6.87
Similarity Score:
N/A
Best Match:
N/A

TRPV3_HUMAN

Docking Scores:
-7.35 -7.20
Similarity Score:
34.58%
Best Match:
CHEMBL3696446

TRXR1_HUMAN

Docking Scores:
-7.93 -7.36 -6.38
Similarity Score:
N/A
Best Match:
N/A

TRY1_HUMAN

Docking Scores:
-7.00
Similarity Score:
53.76%
Best Match:
CHEMBL169291