Job 2 #319 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Cocaine
OPRX_HUMAN

Docking Scores:
-6.75 -6.76 -6.87
Similarity Score:
52.27%
Best Match:
CHEMBL1783822
Prediction Result:
N/A

L: Tramadol
OPRX_HUMAN

Docking Scores:
-6.75 -6.82 -6.58
Similarity Score:
69.66%
Best Match:
CHEMBL233494
Prediction Result:
N/A

L: Cocaine
PTAFR_HUMAN

Docking Scores:
-7.36 -7.28 -7.49
Similarity Score:
40.62%
Best Match:
CHEMBL2304167
Prediction Result:
Active52.78%

L: Tramadol
PTAFR_HUMAN

Docking Scores:
-6.99 -6.99 -7.30
Similarity Score:
58.06%
Best Match:
CHEMBL297624
Prediction Result:
Active74.25%

L: Cocaine
TAAR1_HUMAN

Docking Scores:
-8.33 -7.96 -7.73
Similarity Score:
46.67%
Best Match:
CHEMBL1305977
Prediction Result:
Active66.28%

L: Tramadol
TAAR1_HUMAN

Docking Scores:
-8.31 -7.91 -7.70
Similarity Score:
52.73%
Best Match:
CHEMBL1379139
Prediction Result:
Active76.84%

L: Cocaine
TSHR_HUMAN

Docking Scores:
-9.04 -8.80 -8.47
Similarity Score:
29.44%
Best Match:
CHEMBL3897841
Prediction Result:
Inactive96.86%

L: Tramadol
TSHR_HUMAN

Docking Scores:
-7.82 -7.95 -7.86
Similarity Score:
33.11%
Best Match:
CHEMBL3913851
Prediction Result:
Inactive95.50%

L: Cocaine
V1AR_HUMAN

Docking Scores:
-7.23 -7.23 -7.42
Similarity Score:
41.22%
Best Match:
CHEMBL3416867
Prediction Result:
Inactive89.79%

L: Tramadol
V1AR_HUMAN

Docking Scores:
-5.97 -6.37 -7.79
Similarity Score:
44.09%
Best Match:
CHEMBL3416859
Prediction Result:
Inactive96.08%

L: Cocaine
VIPR1_HUMAN

Docking Scores:
-7.23 -7.84 -7.64
Similarity Score:
30.05%
Best Match:
CHEMBL3884667
Prediction Result:
N/A

L: Tramadol
VIPR1_HUMAN

Docking Scores:
-7.63 -7.73 -7.02
Similarity Score:
29.28%
Best Match:
CHEMBL3884667
Prediction Result:
N/A