test1 #67 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

5HT1A_HUMAN

Docking Scores:
-8.22 -8.30 -7.93
Similarity Score:
40.13%
Best Match:
CHEMBL252258
Prediction Result:
Active53.51%

5HT1B_HUMAN

Docking Scores:
-8.73 -8.80 -8.03
Similarity Score:
30.26%
Best Match:
CHEMBL2113350
Prediction Result:
N/A

5HT1D_HUMAN

Docking Scores:
-8.80 -7.71 -9.01
Similarity Score:
32.04%
Best Match:
CHEMBL343755
Prediction Result:
N/A

5HT1E_HUMAN

Docking Scores:
-8.38 -9.14 -8.56
Similarity Score:
32.04%
Best Match:
CHEMBL343755
Prediction Result:
Inactive64.89%

5HT1F_HUMAN

Docking Scores:
-8.52 -8.52 -8.48
Similarity Score:
21.71%
Best Match:
CHEMBL432713
Prediction Result:
Inactive68.92%

5HT2A_HUMAN

Docking Scores:
-9.87 -9.14
Similarity Score:
38.57%
Best Match:
CHEMBL1277935
Prediction Result:
N/A

5HT2B_HUMAN

Docking Scores:
-8.95 -8.70 -9.15
Similarity Score:
33.51%
Best Match:
CHEMBL1065
Prediction Result:
N/A

5HT2C_HUMAN

Docking Scores:
-8.45 -8.92
Similarity Score:
38.57%
Best Match:
CHEMBL1277935
Prediction Result:
N/A

5HT4R_HUMAN

Docking Scores:
-9.07 -8.66 -8.34
Similarity Score:
31.45%
Best Match:
CHEMBL3759546
Prediction Result:
Inactive74.11%

5HT5A_HUMAN

Docking Scores:
-8.90 -6.92 -7.46
Similarity Score:
34.81%
Best Match:
CHEMBL97518
Prediction Result:
Inactive61.86%

5HT6R_HUMAN

Docking Scores:
-7.70 -8.12 -8.18
Similarity Score:
34.81%
Best Match:
CHEMBL97518
Prediction Result:
Active64.65%

5HT7R_HUMAN

Docking Scores:
-8.18 -8.38 -8.35
Similarity Score:
37.76%
Best Match:
CHEMBL239897
Prediction Result:
Active50.74%

AA1R_HUMAN

Docking Scores:
-8.47 -8.16 -7.70
Similarity Score:
29.73%
Best Match:
CHEMBL329774
Prediction Result:
N/A

AA2AR_HUMAN

Docking Scores:
-7.70 -8.14 -8.78
Similarity Score:
30.22%
Best Match:
CHEMBL2153614
Prediction Result:
N/A

AA2BR_HUMAN

Docking Scores:
-8.59 -8.62 -8.06
Similarity Score:
24.74%
Best Match:
CHEMBL440115
Prediction Result:
Inactive76.88%

AA3R_HUMAN

Docking Scores:
-6.54 -3.12 -7.35
Similarity Score:
39.81%
Best Match:
CHEMBL275040
Prediction Result:
Inactive99.99%

ACM1_HUMAN

Docking Scores:
-6.61 5.77
Similarity Score:
53.21%
Best Match:
CHEMBL301670
Prediction Result:
N/A

ACM2_HUMAN

Docking Scores:
-8.64 -8.23 -6.32
Similarity Score:
53.21%
Best Match:
CHEMBL301670
Prediction Result:
Active63.08%

ACM3_HUMAN

Docking Scores:
-8.70 -8.79 -9.62
Similarity Score:
53.21%
Best Match:
CHEMBL58824
Prediction Result:
Active74.16%

ACM4_HUMAN

Docking Scores:
-7.74 -7.60
Similarity Score:
53.21%
Best Match:
CHEMBL277642
Prediction Result:
N/A