YJING #62 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

5HT1A_HUMAN

Docking Scores:
-9.96 -9.37 -9.75
Similarity Score:
57.84%
Best Match:
CHEMBL573531
Prediction Result:
Active91.53%

5HT1B_HUMAN

Docking Scores:
-10.06 -10.13 -10.77
Similarity Score:
51.24%
Best Match:
CHEMBL515472
Prediction Result:
N/A

5HT1D_HUMAN

Docking Scores:
-10.13 -10.13 -9.80
Similarity Score:
52.80%
Best Match:
CHEMBL100086
Prediction Result:
N/A

5HT1E_HUMAN

Docking Scores:
-9.99 -10.07 -10.15
Similarity Score:
28.24%
Best Match:
CHEMBL2391541
Prediction Result:
Active69.47%

5HT1F_HUMAN

Docking Scores:
-10.00 -9.95 -10.39
Similarity Score:
36.99%
Best Match:
CHEMBL184994
Prediction Result:
Active59.51%

5HT2A_HUMAN

Docking Scores:
-11.14 -10.53
Similarity Score:
52.89%
Best Match:
CHEMBL1093698
Prediction Result:
N/A

5HT2B_HUMAN

Docking Scores:
-10.02 -9.85 -10.01
Similarity Score:
51.24%
Best Match:
CHEMBL515472
Prediction Result:
N/A

5HT2C_HUMAN

Docking Scores:
-9.55 -10.62
Similarity Score:
59.81%
Best Match:
CHEMBL1091104
Prediction Result:
N/A

5HT4R_HUMAN

Docking Scores:
-11.03 -10.82 -10.42
Similarity Score:
50.41%
Best Match:
CHEMBL182590
Prediction Result:
Inactive57.04%

5HT5A_HUMAN

Docking Scores:
-10.03 -9.60 -9.94
Similarity Score:
45.53%
Best Match:
CHEMBL363678
Prediction Result:
Active65.60%

5HT6R_HUMAN

Docking Scores:
-10.15 -10.39 -10.10
Similarity Score:
56.48%
Best Match:
CHEMBL455332
Prediction Result:
Active86.61%

5HT7R_HUMAN

Docking Scores:
-9.31 -10.09 -10.35
Similarity Score:
51.24%
Best Match:
CHEMBL515472
Prediction Result:
Active83.09%

AA1R_HUMAN

Docking Scores:
-10.38 -9.53 -9.63
Similarity Score:
36.05%
Best Match:
CHEMBL3763972
Prediction Result:
N/A

AA2AR_HUMAN

Docking Scores:
-10.03 -10.19 -10.75
Similarity Score:
36.05%
Best Match:
CHEMBL3763972
Prediction Result:
N/A

AA2BR_HUMAN

Docking Scores:
-9.43 -10.00 -9.60
Similarity Score:
32.11%
Best Match:
CHEMBL199826
Prediction Result:
Inactive63.59%

AA3R_HUMAN

Docking Scores:
-8.17 -7.22 -9.61
Similarity Score:
55.43%
Best Match:
CHEMBL27673
Prediction Result:
Active55.59%

ACM1_HUMAN

Docking Scores:
-10.09 -3.10
Similarity Score:
55.43%
Best Match:
CHEMBL27673
Prediction Result:
N/A

ACM2_HUMAN

Docking Scores:
-10.68 -9.34 -10.53
Similarity Score:
55.43%
Best Match:
CHEMBL27673
Prediction Result:
Active62.33%

ACM3_HUMAN

Docking Scores:
-10.57 -11.48 -11.56
Similarity Score:
55.43%
Best Match:
CHEMBL27673
Prediction Result:
Active91.94%

ACM4_HUMAN

Docking Scores:
-10.99 -9.67
Similarity Score:
56.86%
Best Match:
CHEMBL2205825
Prediction Result:
N/A