Etoricoxib #144 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

5HT1B_HUMAN

Docking Scores:
-8.98 -9.35 -10.00
Similarity Score:
36.67%
Best Match:
CHEMBL2419440

5HT2A_HUMAN

Docking Scores:
-8.86 -8.83
Similarity Score:
38.26%
Best Match:
CHEMBL91463

5HT2B_HUMAN

Docking Scores:
-8.74 -9.35 -8.46
Similarity Score:
46.86%
Best Match:
CHEMBL3099899

5HT2C_HUMAN

Docking Scores:
-8.84 -10.37
Similarity Score:
38.26%
Best Match:
CHEMBL91463

AA1R_HUMAN

Docking Scores:
-9.64 -9.37 -8.70
Similarity Score:
47.22%
Best Match:
CHEMBL223828

AA2AR_HUMAN

Docking Scores:
-9.61 -9.73 -9.96
Similarity Score:
54.36%
Best Match:
CHEMBL448781

ACES_HUMAN

Docking Scores:
-9.79 -9.72 -10.41
Similarity Score:
39.26%
Best Match:
CHEMBL3582228

ACE_HUMAN

Docking Scores:
-8.57 -8.67 -6.72
Similarity Score:
29.08%
Best Match:
CHEMBL191

ACHA9_HUMAN

Docking Scores:
-7.11
Similarity Score:
20.81%
Best Match:
CHEMBL386114

ACHB2_HUMAN

Docking Scores:
-5.15 -6.81 -6.60
Similarity Score:
N/A
Best Match:
N/A

ACM1_HUMAN

Docking Scores:
-9.45 -3.41
Similarity Score:
36.09%
Best Match:
CHEMBL3600828

ACM4_HUMAN

Docking Scores:
-9.52 -8.73
Similarity Score:
32.24%
Best Match:
CHEMBL40391

ADRB2_HUMAN

Docking Scores:
-9.43 -8.48 -9.72
Similarity Score:
42.14%
Best Match:
CHEMBL1483308

AGTR2_HUMAN

Docking Scores:
-9.91 -8.98 -9.96
Similarity Score:
33.87%
Best Match:
CHEMBL1017

ALDR_HUMAN

Docking Scores:
-8.86 -9.39 -8.80
Similarity Score:
32.20%
Best Match:
CHEMBL1917446

AMPN_HUMAN

Docking Scores:
-9.06 -9.81 -8.43
Similarity Score:
22.67%
Best Match:
CHEMBL1077591

AOFA_HUMAN

Docking Scores:
-9.21 -9.94 -10.14
Similarity Score:
49.26%
Best Match:
CHEMBL3652429

AOFB_HUMAN

Docking Scores:
-10.19 -9.50 -9.39
Similarity Score:
42.45%
Best Match:
CHEMBL3398531

BACE1_HUMAN

Docking Scores:
-7.96 -7.89 -8.87
Similarity Score:
41.30%
Best Match:
CHEMBL1923751

CAH2_HUMAN

Docking Scores:
-8.02 -9.08 -7.39
Similarity Score:
50.43%
Best Match:
CHEMBL3763387

CASP1_HUMAN

Docking Scores:
-6.11 -7.50 -6.69
Similarity Score:
33.33%
Best Match:
CHEMBL269599

CDK5_HUMAN

Docking Scores:
-7.96 -8.69 -7.04
Similarity Score:
40.82%
Best Match:
CHEMBL1972988

CHLE_HUMAN

Docking Scores:
-9.50 -9.12 -9.01
Similarity Score:
42.74%
Best Match:
CHEMBL3954861

CNR1_HUMAN

Docking Scores:
-7.92 -10.30 -10.40
Similarity Score:
54.48%
Best Match:
CHEMBL247103

CNR2_HUMAN

Docking Scores:
-9.79 -9.85
Similarity Score:
47.13%
Best Match:
CHEMBL577986

COLI_HUMAN

Docking Scores:
-9.10 -8.92 -8.54
Similarity Score:
N/A
Best Match:
N/A

COMT_HUMAN

Docking Scores:
-6.75 -6.36 -6.20
Similarity Score:
34.69%
Best Match:
CHEMBL3798286

CRP_HUMAN

Docking Scores:
-6.56 -6.52
Similarity Score:
N/A
Best Match:
N/A

CXCR1_HUMAN

Docking Scores:
-3.52
Similarity Score:
24.61%
Best Match:
CHEMBL3342269

CXCR4_HUMAN

Docking Scores:
-8.98 -7.25 -8.24
Similarity Score:
26.46%
Best Match:
CHEMBL3627862

DRD2_HUMAN

Docking Scores:
-8.80
Similarity Score:
38.26%
Best Match:
CHEMBL91463

DRD3_HUMAN

Docking Scores:
-7.85
Similarity Score:
36.84%
Best Match:
CHEMBL244773

DRD4_HUMAN

Docking Scores:
-8.89 -9.07
Similarity Score:
33.51%
Best Match:
CHEMBL91553

EDN1_HUMAN

Docking Scores:
-7.86
Similarity Score:
N/A
Best Match:
N/A

ESR1_HUMAN

Docking Scores:
-9.12 -9.58 -9.43
Similarity Score:
46.46%
Best Match:
CHEMBL371012

FABP5_HUMAN

Docking Scores:
-8.66 -7.10 -6.31
Similarity Score:
34.59%
Best Match:
CHEMBL3971182

FYN_HUMAN

Docking Scores:
-9.14
Similarity Score:
40.57%
Best Match:
CHEMBL1997822

GLRA3_HUMAN

Docking Scores:
-8.87 -9.04 -8.41
Similarity Score:
20.97%
Best Match:
CHEMBL4070615

GLRA3_HUMAN

Docking Scores:
-9.20
Similarity Score:
20.97%
Best Match:
CHEMBL4070615

GRM5_HUMAN

Docking Scores:
-6.90 -8.85 -7.45
Similarity Score:
46.21%
Best Match:
CHEMBL3603921

HPGDS_HUMAN

Docking Scores:
-8.07 -7.59 -7.18
Similarity Score:
53.91%
Best Match:
CHEMBL3917928

HRH1_HUMAN

Docking Scores:
-7.08
Similarity Score:
34.43%
Best Match:
CHEMBL1784685

HYES_HUMAN

Docking Scores:
-8.37 -10.09 -8.61
Similarity Score:
34.64%
Best Match:
CHEMBL567703

IKKB_HUMAN

Docking Scores:
-9.27
Similarity Score:
42.50%
Best Match:
CHEMBL4061406

MDR1_HUMAN

Docking Scores:
-9.00 -8.50
Similarity Score:
34.92%
Best Match:
CHEMBL1642

MIF_HUMAN

Docking Scores:
-6.51 -7.37 -6.83
Similarity Score:
30.37%
Best Match:
CHEMBL3906441

MK01_HUMAN

Docking Scores:
-8.04 -8.01 -7.63
Similarity Score:
43.79%
Best Match:
CHEMBL3944658

MK03_HUMAN

Docking Scores:
-8.30 -9.06 -8.33
Similarity Score:
36.99%
Best Match:
CHEMBL1089119

MTOR_HUMAN

Docking Scores:
-9.20 -9.69 -9.37
Similarity Score:
47.88%
Best Match:
CHEMBL3640942

NEP_HUMAN

Docking Scores:
-8.25 -6.96 -8.25
Similarity Score:
25.26%
Best Match:
CHEMBL4085997

NK1R_HUMAN

Docking Scores:
-8.49 -9.21 -8.42
Similarity Score:
46.56%
Best Match:
CHEMBL21122

NMDE1_HUMAN

Docking Scores:
-7.54 -9.92 -8.83
Similarity Score:
21.97%
Best Match:
CHEMBL2333945

NMDE2_HUMAN

Docking Scores:
-10.26 -9.01 -9.98
Similarity Score:
32.61%
Best Match:
CHEMBL570613

NMDZ1_HUMAN

Docking Scores:
-9.22 -10.01 -8.83
Similarity Score:
30.37%
Best Match:
CHEMBL164322

NOS1_HUMAN

Docking Scores:
-8.00 -7.40 -7.60
Similarity Score:
37.50%
Best Match:
CHEMBL4084332

NOS2_HUMAN

Docking Scores:
-7.50 -8.50 -8.57
Similarity Score:
34.29%
Best Match:
CHEMBL1800534

NTRK1_HUMAN

Docking Scores:
-9.77 -9.90 -9.99
Similarity Score:
42.22%
Best Match:
CHEMBL2152276

OPRD_HUMAN

Docking Scores:
-8.26 -7.60 -8.08
Similarity Score:
33.16%
Best Match:
CHEMBL2347239

OPRK_HUMAN

Docking Scores:
-9.69 -8.94 -8.47
Similarity Score:
38.07%
Best Match:
CHEMBL1818237

OPRM_MOUSE

Docking Scores:
-9.05 -7.71
Similarity Score:
25.36%
Best Match:
CHEMBL2147903

OPRX_HUMAN

Docking Scores:
-7.79 -8.12 -7.33
Similarity Score:
34.43%
Best Match:
CHEMBL1784685

P2RX3_HUMAN

Docking Scores:
-6.06 -6.10 -6.31
Similarity Score:
30.41%
Best Match:
CHEMBL3643305

P2Y12_HUMAN

Docking Scores:
-9.98 -7.71 -8.05
Similarity Score:
31.00%
Best Match:
CHEMBL3322630

PAR1_HUMAN

Docking Scores:
-10.14
Similarity Score:
40.59%
Best Match:
CHEMBL231942

PDE4B_HUMAN

Docking Scores:
-9.54 -9.64 -9.65
Similarity Score:
55.88%
Best Match:
CHEMBL1957298

PDE5A_HUMAN

Docking Scores:
-9.47 -10.07 -9.56
Similarity Score:
38.38%
Best Match:
CHEMBL3742354

PERM_HUMAN

Docking Scores:
-8.48 -8.66 -8.34
Similarity Score:
23.08%
Best Match:
CHEMBL2347182

PGH1_SHEEP

Docking Scores:
-7.06 -6.79 -8.70
Similarity Score:
41.36%
Best Match:
CHEMBL389379

PGH2_HUMAN

Docking Scores:
-7.46 -8.41 -11.14
Similarity Score:
100.00%
Best Match:
CHEMBL416146

PPAP_HUMAN

Docking Scores:
-8.08
Similarity Score:
11.04%
Best Match:
CHEMBL453954

PPARG_HUMAN

Docking Scores:
-8.05 -9.14 -8.27
Similarity Score:
41.67%
Best Match:
CHEMBL3695769

PRGR_HUMAN

Docking Scores:
-3.45 -0.80 -8.28
Similarity Score:
37.50%
Best Match:
CHEMBL3605932

PTGES_HUMAN

Docking Scores:
-7.61
Similarity Score:
51.09%
Best Match:
CHEMBL585295

SC6A4_HUMAN

Docking Scores:
-9.32 -9.16 -8.96
Similarity Score:
36.67%
Best Match:
CHEMBL2419440

SCN9A_HUMAN

Docking Scores:
-8.51
Similarity Score:
46.11%
Best Match:
CHEMBL3682760

TLR4_HUMAN

Docking Scores:
-7.97 -8.33 -7.72
Similarity Score:
24.57%
Best Match:
CHEMBL3823499

TNFA_HUMAN

Docking Scores:
-7.68
Similarity Score:
31.91%
Best Match:
CHEMBL3640372

TRBM_HUMAN

Docking Scores:
-8.45 -7.31
Similarity Score:
N/A
Best Match:
N/A

TRPM4_HUMAN

Docking Scores:
-6.96 -7.06
Similarity Score:
N/A
Best Match:
N/A

TRPM8_FICAL

Docking Scores:
-9.56
Similarity Score:
N/A
Best Match:
N/A

TRPV1_RAT

Docking Scores:
-7.22
Similarity Score:
40.26%
Best Match:
CHEMBL276153

TRPV2_RABIT

Docking Scores:
-7.46 -6.89
Similarity Score:
N/A
Best Match:
N/A

TRPV3_HUMAN

Docking Scores:
-7.19 -8.16
Similarity Score:
47.27%
Best Match:
CHEMBL3692319

TRXR1_HUMAN

Docking Scores:
-7.95 -7.52 -7.05
Similarity Score:
N/A
Best Match:
N/A

TRY1_HUMAN

Docking Scores:
-7.28
Similarity Score:
38.36%
Best Match:
CHEMBL92883