WangYuanqiang #189 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

5HT1A_HUMAN

Docking Scores:
-6.82 -7.05 -6.80
Similarity Score:
39.13%
Best Match:
CHEMBL3769446
Prediction Result:
Active59.82%

5HT1B_HUMAN

Docking Scores:
-6.95 -7.25 -7.17
Similarity Score:
38.89%
Best Match:
CHEMBL73281
Prediction Result:
N/A

5HT1D_HUMAN

Docking Scores:
-7.05 -7.16 -5.97
Similarity Score:
38.89%
Best Match:
CHEMBL73281
Prediction Result:
N/A

5HT1E_HUMAN

Docking Scores:
-6.82 -6.57 -6.82
Similarity Score:
22.22%
Best Match:
CHEMBL39
Prediction Result:
Inactive61.19%

5HT1F_HUMAN

Docking Scores:
-6.76 -7.76 -6.93
Similarity Score:
24.30%
Best Match:
CHEMBL318110
Prediction Result:
Inactive74.81%

5HT2A_HUMAN

Docking Scores:
-7.38 -7.27
Similarity Score:
50.00%
Best Match:
CHEMBL104088
Prediction Result:
N/A

5HT2B_HUMAN

Docking Scores:
-7.22 -8.14 -7.29
Similarity Score:
52.00%
Best Match:
CHEMBL475643
Prediction Result:
N/A

5HT2C_HUMAN

Docking Scores:
-8.00 -8.13
Similarity Score:
52.00%
Best Match:
CHEMBL475643
Prediction Result:
N/A

5HT4R_HUMAN

Docking Scores:
-8.03 -7.98 -7.30
Similarity Score:
25.00%
Best Match:
CHEMBL309655
Prediction Result:
Inactive80.89%

5HT5A_HUMAN

Docking Scores:
-7.24 -7.05 -6.97
Similarity Score:
30.53%
Best Match:
CHEMBL161507
Prediction Result:
Inactive62.98%

5HT6R_HUMAN

Docking Scores:
-6.65 -6.71 -7.25
Similarity Score:
39.39%
Best Match:
CHEMBL17157
Prediction Result:
Inactive50.53%

5HT7R_HUMAN

Docking Scores:
-6.95 -7.71 -6.75
Similarity Score:
42.11%
Best Match:
CHEMBL443757
Prediction Result:
Inactive57.08%

AA1R_HUMAN

Docking Scores:
-7.23 -7.03 -7.92
Similarity Score:
31.46%
Best Match:
CHEMBL1544
Prediction Result:
N/A

AA2AR_HUMAN

Docking Scores:
-7.12 -7.39 -7.43
Similarity Score:
26.39%
Best Match:
CHEMBL86771
Prediction Result:
N/A

AA2BR_HUMAN

Docking Scores:
-7.21 -7.27 -6.80
Similarity Score:
28.33%
Best Match:
CHEMBL2113345
Prediction Result:
Inactive57.74%

AA3R_HUMAN

Docking Scores:
-8.05 -8.09 -7.02
Similarity Score:
50.00%
Best Match:
CHEMBL701
Prediction Result:
Active70.42%

ACM1_HUMAN

Docking Scores:
-7.76 -7.22
Similarity Score:
51.52%
Best Match:
CHEMBL2164888
Prediction Result:
N/A

ACM2_HUMAN

Docking Scores:
-7.18 -6.57 -7.75
Similarity Score:
50.75%
Best Match:
CHEMBL1191560
Prediction Result:
Inactive53.37%

ACM3_HUMAN

Docking Scores:
-6.70 -7.44 -7.82
Similarity Score:
50.75%
Best Match:
CHEMBL1191560
Prediction Result:
Active54.60%

ACM4_HUMAN

Docking Scores:
-7.86 -7.83
Similarity Score:
50.00%
Best Match:
CHEMBL2377392
Prediction Result:
N/A