LTJv2 #75 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Etoricoxib
OPRX_HUMAN

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

L: Indomethacin
OPRX_HUMAN

Docking Scores:
-7.49 -7.25 -7.46
Similarity Score:
50.33%
Best Match:
CHEMBL212574

L: Fenbufen
OPRX_HUMAN

Docking Scores:
-7.53 -7.37 -7.57
Similarity Score:
40.00%
Best Match:
CHEMBL3937167

L: Celecoxib
OPRX_HUMAN

Docking Scores:
-8.63 -8.63 -7.90
Similarity Score:
54.10%
Best Match:
CHEMBL558524

L: Diclofenac
OPRX_HUMAN

Docking Scores:
-7.36 -7.11 -6.85
Similarity Score:
34.78%
Best Match:
CHEMBL317152

L: Etoricoxib
P2RX3_HUMAN

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

L: Indomethacin
P2RX3_HUMAN

Docking Scores:
-6.23 -6.00 -6.19
Similarity Score:
46.19%
Best Match:
CHEMBL3978296

L: Fenbufen
P2RX3_HUMAN

Docking Scores:
-5.89 -5.87 -6.13
Similarity Score:
31.94%
Best Match:
CHEMBL3669699

L: Celecoxib
P2RX3_HUMAN

Docking Scores:
-6.40 -6.31 -6.92
Similarity Score:
32.08%
Best Match:
CHEMBL3959244

L: Diclofenac
P2RX3_HUMAN

Docking Scores:
-5.89 -4.93 -5.45
Similarity Score:
45.71%
Best Match:
CHEMBL3958199

L: Etoricoxib
P2Y12_HUMAN

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

L: Indomethacin
P2Y12_HUMAN

Docking Scores:
-8.52 -7.16 -7.66
Similarity Score:
42.73%
Best Match:
CHEMBL3325895

L: Fenbufen
P2Y12_HUMAN

Docking Scores:
-8.61 -9.03 -8.77
Similarity Score:
39.81%
Best Match:
CHEMBL420980

L: Celecoxib
P2Y12_HUMAN

Docking Scores:
-9.95 -7.17 -7.84
Similarity Score:
35.96%
Best Match:
CHEMBL3325792

L: Diclofenac
P2Y12_HUMAN

Docking Scores:
-8.30 -6.08 -7.72
Similarity Score:
30.00%
Best Match:
CHEMBL223344

L: Etoricoxib
PAR1_HUMAN

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

L: Indomethacin
PAR1_HUMAN

Docking Scores:
-6.50
Similarity Score:
40.36%
Best Match:
CHEMBL7610

L: Fenbufen
PAR1_HUMAN

Docking Scores:
-9.15
Similarity Score:
37.70%
Best Match:
CHEMBL2012487

L: Celecoxib
PAR1_HUMAN

Docking Scores:
-7.56
Similarity Score:
30.95%
Best Match:
CHEMBL63426

L: Diclofenac
PAR1_HUMAN

Docking Scores:
-8.31
Similarity Score:
29.75%
Best Match:
CHEMBL2049115