test #45 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

5HT1A_HUMAN

Docking Scores:
-6.12 -5.75 -5.82
Similarity Score:
48.21%
Best Match:
CHEMBL146942
Prediction Result:
Active53.72%

5HT1B_HUMAN

Docking Scores:
-6.57 -6.29 -6.07
Similarity Score:
48.21%
Best Match:
CHEMBL146942
Prediction Result:
N/A

5HT1D_HUMAN

Docking Scores:
-6.25 -6.41 -6.18
Similarity Score:
43.75%
Best Match:
CHEMBL73281
Prediction Result:
N/A

5HT1E_HUMAN

Docking Scores:
-6.30 -6.41 -6.59
Similarity Score:
24.00%
Best Match:
CHEMBL39
Prediction Result:
Inactive60.65%

5HT1F_HUMAN

Docking Scores:
-6.39 -6.81 -6.58
Similarity Score:
24.49%
Best Match:
CHEMBL3617549
Prediction Result:
Inactive76.99%

5HT2A_HUMAN

Docking Scores:
-6.71 -6.43
Similarity Score:
70.00%
Best Match:
CHEMBL445747
Prediction Result:
N/A

5HT2B_HUMAN

Docking Scores:
-6.90 -6.87 -6.95
Similarity Score:
70.00%
Best Match:
CHEMBL445747
Prediction Result:
N/A

5HT2C_HUMAN

Docking Scores:
-6.96 -6.84
Similarity Score:
70.00%
Best Match:
CHEMBL445747
Prediction Result:
N/A

5HT4R_HUMAN

Docking Scores:
-6.60 -6.82 -6.41
Similarity Score:
27.27%
Best Match:
CHEMBL80015
Prediction Result:
Inactive60.61%

5HT5A_HUMAN

Docking Scores:
-6.67 -6.36 -6.39
Similarity Score:
34.09%
Best Match:
CHEMBL161507
Prediction Result:
Inactive52.75%

5HT6R_HUMAN

Docking Scores:
-6.17 -6.00 -6.05
Similarity Score:
48.21%
Best Match:
CHEMBL146942
Prediction Result:
Inactive56.56%

5HT7R_HUMAN

Docking Scores:
-6.37 -6.67 -6.54
Similarity Score:
53.06%
Best Match:
CHEMBL443757
Prediction Result:
Active90.84%

AA1R_HUMAN

Docking Scores:
-6.48 -6.74 -6.85
Similarity Score:
29.07%
Best Match:
CHEMBL1544
Prediction Result:
N/A

AA2AR_HUMAN

Docking Scores:
-7.02 -6.85 -6.54
Similarity Score:
26.87%
Best Match:
CHEMBL86771
Prediction Result:
N/A

AA2BR_HUMAN

Docking Scores:
-6.01 -6.21 -5.60
Similarity Score:
21.21%
Best Match:
CHEMBL67949
Prediction Result:
Inactive63.00%

AA3R_HUMAN

Docking Scores:
-7.54 -7.43 -6.07
Similarity Score:
42.11%
Best Match:
CHEMBL701
Prediction Result:
Active66.38%

ACM1_HUMAN

Docking Scores:
-6.88 -7.56
Similarity Score:
49.15%
Best Match:
CHEMBL3084679
Prediction Result:
N/A

ACM2_HUMAN

Docking Scores:
-6.21 -5.97 -6.88
Similarity Score:
49.15%
Best Match:
CHEMBL3084679
Prediction Result:
Active70.92%

ACM3_HUMAN

Docking Scores:
-5.72 -6.50 -6.98
Similarity Score:
50.88%
Best Match:
CHEMBL3084397
Prediction Result:
Active51.52%

ACM4_HUMAN

Docking Scores:
-7.04 -6.78
Similarity Score:
47.54%
Best Match:
CHEMBL1490
Prediction Result:
N/A