test #573 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

5HT1A_HUMAN

Docking Scores:
-6.06 -5.89 -6.23
Similarity Score:
44.07%
Best Match:
CHEMBL4648489
Prediction Result:
Active53.41%

5HT1B_HUMAN

Docking Scores:
-6.66 -6.61 -6.57
Similarity Score:
52.27%
Best Match:
CHEMBL73281
Prediction Result:
N/A

5HT1D_HUMAN

Docking Scores:
-6.42 -6.26 -6.91
Similarity Score:
52.27%
Best Match:
CHEMBL73281
Prediction Result:
N/A

5HT1E_HUMAN

Docking Scores:
-6.39 -6.76 -6.52
Similarity Score:
26.14%
Best Match:
CHEMBL4092027
Prediction Result:
Inactive58.40%

5HT1F_HUMAN

Docking Scores:
-6.42 -6.72 -6.59
Similarity Score:
26.14%
Best Match:
CHEMBL4092027
Prediction Result:
Inactive75.82%

5HT2A_HUMAN

Docking Scores:
-6.84 -6.41
Similarity Score:
65.00%
Best Match:
CHEMBL445747
Prediction Result:
N/A

5HT2B_HUMAN

Docking Scores:
-7.01 -6.64 -7.01
Similarity Score:
70.00%
Best Match:
CHEMBL475643
Prediction Result:
N/A

5HT2C_HUMAN

Docking Scores:
-6.93 -6.77
Similarity Score:
70.00%
Best Match:
CHEMBL475643
Prediction Result:
N/A

5HT4R_HUMAN

Docking Scores:
-7.06 -7.01 -6.76
Similarity Score:
27.16%
Best Match:
CHEMBL4567394
Prediction Result:
Inactive64.11%

5HT5A_HUMAN

Docking Scores:
-6.40 -6.32 -6.32
Similarity Score:
31.82%
Best Match:
CHEMBL161507
Prediction Result:
Inactive56.61%

5HT6R_HUMAN

Docking Scores:
-5.92 -5.95 -6.51
Similarity Score:
47.37%
Best Match:
CHEMBL17157
Prediction Result:
Inactive57.22%

5HT7R_HUMAN

Docking Scores:
-6.19 -6.63 -6.20
Similarity Score:
44.68%
Best Match:
CHEMBL234885
Prediction Result:
Active57.97%

AA1R_HUMAN

Docking Scores:
-6.29 -6.79 -6.91
Similarity Score:
28.24%
Best Match:
CHEMBL103150
Prediction Result:
N/A

AA2AR_HUMAN

Docking Scores:
-6.88 -6.79 -6.66
Similarity Score:
29.23%
Best Match:
CHEMBL496
Prediction Result:
N/A

AA2BR_HUMAN

Docking Scores:
-6.08 -6.18 -5.75
Similarity Score:
22.92%
Best Match:
CHEMBL67949
Prediction Result:
Inactive59.24%

AA3R_HUMAN

Docking Scores:
-7.43 -7.14 -6.17
Similarity Score:
29.23%
Best Match:
CHEMBL496
Prediction Result:
Active56.08%

ACM1_HUMAN

Docking Scores:
-6.96 -7.23
Similarity Score:
46.43%
Best Match:
CHEMBL936
Prediction Result:
N/A

ACM2_HUMAN

Docking Scores:
-6.63 -6.15 -6.80
Similarity Score:
46.43%
Best Match:
CHEMBL936
Prediction Result:
Active58.58%

ACM3_HUMAN

Docking Scores:
-5.62 -6.55 -6.80
Similarity Score:
46.43%
Best Match:
CHEMBL936
Prediction Result:
Inactive52.65%

ACM4_HUMAN

Docking Scores:
-6.98 -6.92
Similarity Score:
46.43%
Best Match:
CHEMBL936
Prediction Result:
N/A