test #46 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

5HT1A_HUMAN

Docking Scores:
-7.71 -7.09 -8.02
Similarity Score:
41.54%
Best Match:
CHEMBL146942
Prediction Result:
Inactive65.27%

5HT1B_HUMAN

Docking Scores:
-8.38 -8.00 -7.92
Similarity Score:
41.54%
Best Match:
CHEMBL146942
Prediction Result:
N/A

5HT1D_HUMAN

Docking Scores:
-7.91 -7.81 -7.06
Similarity Score:
40.79%
Best Match:
CHEMBL140415
Prediction Result:
N/A

5HT1E_HUMAN

Docking Scores:
-7.64 -7.81 -7.19
Similarity Score:
21.43%
Best Match:
CHEMBL39
Prediction Result:
Active59.10%

5HT1F_HUMAN

Docking Scores:
-7.90 -7.94 -8.35
Similarity Score:
25.00%
Best Match:
CHEMBL497963
Prediction Result:
Inactive64.17%

5HT2A_HUMAN

Docking Scores:
-8.76 -8.54
Similarity Score:
57.14%
Best Match:
CHEMBL445747
Prediction Result:
N/A

5HT2B_HUMAN

Docking Scores:
-7.76 -7.96 -8.05
Similarity Score:
57.14%
Best Match:
CHEMBL445747
Prediction Result:
N/A

5HT2C_HUMAN

Docking Scores:
-8.48 -8.31
Similarity Score:
64.91%
Best Match:
CHEMBL474950
Prediction Result:
N/A

5HT4R_HUMAN

Docking Scores:
-8.92 -9.15 -8.63
Similarity Score:
25.00%
Best Match:
CHEMBL80015
Prediction Result:
Inactive84.50%

5HT5A_HUMAN

Docking Scores:
-8.42 -7.68 -8.19
Similarity Score:
37.18%
Best Match:
CHEMBL187415
Prediction Result:
Inactive70.09%

5HT6R_HUMAN

Docking Scores:
-7.95 -7.74 -7.86
Similarity Score:
41.54%
Best Match:
CHEMBL146942
Prediction Result:
Active60.02%

5HT7R_HUMAN

Docking Scores:
-7.94 -7.59 -7.74
Similarity Score:
61.22%
Best Match:
CHEMBL234885
Prediction Result:
Active71.49%

AA1R_HUMAN

Docking Scores:
-8.52 -8.36 -8.62
Similarity Score:
29.06%
Best Match:
CHEMBL220118
Prediction Result:
N/A

AA2AR_HUMAN

Docking Scores:
-8.38 -8.54 -8.45
Similarity Score:
29.06%
Best Match:
CHEMBL220118
Prediction Result:
N/A

AA2BR_HUMAN

Docking Scores:
-7.27 -7.81 -7.13
Similarity Score:
24.04%
Best Match:
CHEMBL222719
Prediction Result:
Inactive62.85%

AA3R_HUMAN

Docking Scores:
-9.30 -8.70 -7.74
Similarity Score:
36.36%
Best Match:
CHEMBL701
Prediction Result:
Active83.33%

ACM1_HUMAN

Docking Scores:
-8.64 -9.74
Similarity Score:
45.07%
Best Match:
CHEMBL72506
Prediction Result:
N/A

ACM2_HUMAN

Docking Scores:
-8.08 -7.45 -9.03
Similarity Score:
45.07%
Best Match:
CHEMBL72506
Prediction Result:
Active61.42%

ACM3_HUMAN

Docking Scores:
-7.37 -8.38 -9.20
Similarity Score:
43.94%
Best Match:
CHEMBL3084397
Prediction Result:
Active56.48%

ACM4_HUMAN

Docking Scores:
-8.99 -8.61
Similarity Score:
41.77%
Best Match:
CHEMBL443780
Prediction Result:
N/A