job final #323 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

5HT1A_HUMAN

Docking Scores:
-8.68 -7.64 -8.26
Similarity Score:
47.55%
Best Match:
CHEMBL49838
Prediction Result:
Inactive52.43%

5HT1B_HUMAN

Docking Scores:
-8.84 -9.16 -9.67
Similarity Score:
46.63%
Best Match:
CHEMBL29951
Prediction Result:
N/A

5HT1D_HUMAN

Docking Scores:
-9.15 -7.59 -7.55
Similarity Score:
46.63%
Best Match:
CHEMBL29951
Prediction Result:
N/A

5HT1E_HUMAN

Docking Scores:
-8.24 -7.61 -8.21
Similarity Score:
26.49%
Best Match:
CHEMBL343755
Prediction Result:
Inactive71.03%

5HT1F_HUMAN

Docking Scores:
-9.28 -9.38 -9.60
Similarity Score:
26.47%
Best Match:
CHEMBL497963
Prediction Result:
Inactive71.38%

5HT2A_HUMAN

Docking Scores:
-9.45 -7.40
Similarity Score:
47.74%
Best Match:
CHEMBL3695438
Prediction Result:
N/A

5HT2B_HUMAN

Docking Scores:
-8.63 -8.94 -9.24
Similarity Score:
45.71%
Best Match:
CHEMBL445106
Prediction Result:
N/A

5HT2C_HUMAN

Docking Scores:
-8.91 -9.12
Similarity Score:
45.71%
Best Match:
CHEMBL445106
Prediction Result:
N/A

5HT4R_HUMAN

Docking Scores:
-9.55 -9.30 -7.46
Similarity Score:
36.73%
Best Match:
CHEMBL571799
Prediction Result:
Inactive59.81%

5HT5A_HUMAN

Docking Scores:
-9.92 -7.50 -8.25
Similarity Score:
41.05%
Best Match:
CHEMBL278751
Prediction Result:
Inactive74.19%

5HT6R_HUMAN

Docking Scores:
-8.27 -7.96 -7.77
Similarity Score:
43.36%
Best Match:
CHEMBL429023
Prediction Result:
Active63.09%

5HT7R_HUMAN

Docking Scores:
-8.86 -9.18 -9.31
Similarity Score:
42.06%
Best Match:
CHEMBL3581246
Prediction Result:
Active74.24%

AA1R_HUMAN

Docking Scores:
-8.28 -9.04 -7.24
Similarity Score:
29.48%
Best Match:
CHEMBL1090687
Prediction Result:
N/A

AA2AR_HUMAN

Docking Scores:
-7.48 -7.87 -9.48
Similarity Score:
35.71%
Best Match:
CHEMBL559023
Prediction Result:
N/A

AA2BR_HUMAN

Docking Scores:
-8.90 -8.88 -9.01
Similarity Score:
30.71%
Best Match:
CHEMBL589251
Prediction Result:
Inactive53.78%

AA3R_HUMAN

Docking Scores:
-4.56 -4.37 -8.41
Similarity Score:
55.86%
Best Match:
CHEMBL80
Prediction Result:
Active62.29%

ACM1_HUMAN

Docking Scores:
-9.46 4.59
Similarity Score:
43.05%
Best Match:
CHEMBL2312344
Prediction Result:
N/A

ACM2_HUMAN

Docking Scores:
-9.90 -8.69 -10.25
Similarity Score:
40.51%
Best Match:
CHEMBL343236
Prediction Result:
Inactive52.32%

ACM3_HUMAN

Docking Scores:
-8.90 -9.54 -8.35
Similarity Score:
40.77%
Best Match:
CHEMBL1921911
Prediction Result:
Active59.88%

ACM4_HUMAN

Docking Scores:
-7.77 -7.29
Similarity Score:
38.46%
Best Match:
CHEMBL1346
Prediction Result:
N/A