chenyan1 #43 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

5HT1A_HUMAN

Docking Scores:
-11.05 -9.94 -9.92
Similarity Score:
46.19%
Best Match:
CHEMBL1242904
Prediction Result:
Active73.03%

5HT1B_HUMAN

Docking Scores:
-11.81 -11.65 -11.02
Similarity Score:
46.19%
Best Match:
CHEMBL1242904
Prediction Result:
N/A

5HT1D_HUMAN

Docking Scores:
-11.77 -10.70 -10.65
Similarity Score:
46.19%
Best Match:
CHEMBL1242904
Prediction Result:
N/A

5HT1E_HUMAN

Docking Scores:
-10.70 -8.38 -10.46
Similarity Score:
33.70%
Best Match:
CHEMBL267615
Prediction Result:
Inactive58.67%

5HT1F_HUMAN

Docking Scores:
-10.78 -11.28 -10.60
Similarity Score:
33.67%
Best Match:
CHEMBL497963
Prediction Result:
Inactive59.85%

5HT2A_HUMAN

Docking Scores:
-12.02 -11.25
Similarity Score:
45.05%
Best Match:
CHEMBL1222553
Prediction Result:
N/A

5HT2B_HUMAN

Docking Scores:
-11.85 -10.97 -10.86
Similarity Score:
44.83%
Best Match:
CHEMBL1222624
Prediction Result:
N/A

5HT2C_HUMAN

Docking Scores:
-11.49 -10.94
Similarity Score:
45.05%
Best Match:
CHEMBL1222554
Prediction Result:
N/A

5HT4R_HUMAN

Docking Scores:
-11.93 -12.08 -10.15
Similarity Score:
37.07%
Best Match:
CHEMBL2402898
Prediction Result:
Active51.32%

5HT5A_HUMAN

Docking Scores:
-9.76 -9.54 -10.25
Similarity Score:
42.64%
Best Match:
CHEMBL435814
Prediction Result:
Active74.58%

5HT6R_HUMAN

Docking Scores:
-12.04 -10.48 -11.68
Similarity Score:
44.21%
Best Match:
CHEMBL3409251
Prediction Result:
Active87.82%

5HT7R_HUMAN

Docking Scores:
-11.28 -10.82 -10.79
Similarity Score:
45.36%
Best Match:
CHEMBL476862
Prediction Result:
Active69.22%

AA1R_HUMAN

Docking Scores:
-9.90 -11.22 -6.98
Similarity Score:
46.60%
Best Match:
CHEMBL3317571
Prediction Result:
N/A

AA2AR_HUMAN

Docking Scores:
-10.68 -10.89 -9.65
Similarity Score:
53.23%
Best Match:
CHEMBL2312988
Prediction Result:
N/A

AA2BR_HUMAN

Docking Scores:
-10.72 -11.12 -10.29
Similarity Score:
40.60%
Best Match:
CHEMBL260692
Prediction Result:
Inactive63.01%

AA3R_HUMAN

Docking Scores:
-1.18 -4.19 0.18
Similarity Score:
41.38%
Best Match:
CHEMBL4062581
Prediction Result:
Inactive99.99%

ACM1_HUMAN

Docking Scores:
-9.29 33.28
Similarity Score:
41.75%
Best Match:
CHEMBL603713
Prediction Result:
N/A

ACM2_HUMAN

Docking Scores:
-11.64 -10.56 -7.24
Similarity Score:
37.93%
Best Match:
CHEMBL296419
Prediction Result:
Active63.55%

ACM3_HUMAN

Docking Scores:
-10.87 -12.54 -11.04
Similarity Score:
40.30%
Best Match:
CHEMBL1836644
Prediction Result:
Active60.90%

ACM4_HUMAN

Docking Scores:
-7.42 -8.17
Similarity Score:
39.50%
Best Match:
CHEMBL3808485
Prediction Result:
N/A