Trequinsin_BBB #453 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

OPRX_HUMAN

Docking Scores:
-8.63 -7.53 -7.93
Similarity Score:
34.32%
Best Match:
CHEMBL480425
Prediction Result:
N/A

PTAFR_HUMAN

Docking Scores:
-9.44 -8.92 -9.36
Similarity Score:
34.92%
Best Match:
CHEMBL37602
Prediction Result:
Active50.82%

TAAR1_HUMAN

Docking Scores:
-8.70 -10.19 -10.01
Similarity Score:
36.80%
Best Match:
CHEMBL2355180
Prediction Result:
Inactive71.60%

TSHR_HUMAN

Docking Scores:
-10.64 -10.73 -8.63
Similarity Score:
36.47%
Best Match:
CHEMBL1357440
Prediction Result:
Active52.56%

V1AR_HUMAN

Docking Scores:
-8.85 -8.33 -9.43
Similarity Score:
34.69%
Best Match:
CHEMBL3942564
Prediction Result:
Inactive85.69%

VIPR1_HUMAN

Docking Scores:
-8.90 -9.67 -9.13
Similarity Score:
32.20%
Best Match:
CHEMBL1784694
Prediction Result:
N/A