YJING #63 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

5HT1A_HUMAN

Docking Scores:
-8.76 -8.51 -7.95
Similarity Score:
61.18%
Best Match:
CHEMBL1254829
Prediction Result:
Active83.82%

5HT1B_HUMAN

Docking Scores:
-9.21 -9.28 -9.18
Similarity Score:
54.32%
Best Match:
CHEMBL140416
Prediction Result:
N/A

5HT1D_HUMAN

Docking Scores:
-8.88 -8.73 -8.07
Similarity Score:
54.32%
Best Match:
CHEMBL140416
Prediction Result:
N/A

5HT1E_HUMAN

Docking Scores:
-9.19 -8.89 -9.26
Similarity Score:
28.46%
Best Match:
CHEMBL2391541
Prediction Result:
Inactive67.38%

5HT1F_HUMAN

Docking Scores:
-8.88 -8.60 -9.28
Similarity Score:
34.75%
Best Match:
CHEMBL184994
Prediction Result:
Inactive57.35%

5HT2A_HUMAN

Docking Scores:
-8.95 -9.47
Similarity Score:
53.47%
Best Match:
CHEMBL3260337
Prediction Result:
N/A

5HT2B_HUMAN

Docking Scores:
-8.42 -8.62 -9.11
Similarity Score:
44.76%
Best Match:
CHEMBL3260334
Prediction Result:
N/A

5HT2C_HUMAN

Docking Scores:
-8.56 -9.58
Similarity Score:
50.47%
Best Match:
CHEMBL1091104
Prediction Result:
N/A

5HT4R_HUMAN

Docking Scores:
-9.90 -9.62 -9.42
Similarity Score:
42.15%
Best Match:
CHEMBL182590
Prediction Result:
Active63.20%

5HT5A_HUMAN

Docking Scores:
-8.93 -8.35 -8.64
Similarity Score:
43.93%
Best Match:
CHEMBL126667
Prediction Result:
Inactive51.34%

5HT6R_HUMAN

Docking Scores:
-8.48 -7.70 -9.07
Similarity Score:
50.00%
Best Match:
CHEMBL455332
Prediction Result:
Active79.96%

5HT7R_HUMAN

Docking Scores:
-8.16 -8.28 -9.17
Similarity Score:
44.59%
Best Match:
CHEMBL3581255
Prediction Result:
Active72.32%

AA1R_HUMAN

Docking Scores:
-9.30 -8.30 -8.96
Similarity Score:
38.27%
Best Match:
CHEMBL3763972
Prediction Result:
N/A

AA2AR_HUMAN

Docking Scores:
-8.83 -9.12 -9.80
Similarity Score:
38.27%
Best Match:
CHEMBL3763972
Prediction Result:
N/A

AA2BR_HUMAN

Docking Scores:
-8.31 -8.83 -8.16
Similarity Score:
33.15%
Best Match:
CHEMBL199826
Prediction Result:
Inactive68.02%

AA3R_HUMAN

Docking Scores:
-8.24 -8.74 -9.80
Similarity Score:
40.00%
Best Match:
CHEMBL27673
Prediction Result:
Inactive67.29%

ACM1_HUMAN

Docking Scores:
-8.97 -6.03
Similarity Score:
44.66%
Best Match:
CHEMBL221753
Prediction Result:
N/A

ACM2_HUMAN

Docking Scores:
-9.34 -8.01 -9.20
Similarity Score:
47.12%
Best Match:
CHEMBL2151158
Prediction Result:
Active63.06%

ACM3_HUMAN

Docking Scores:
-8.30 -9.69 -10.05
Similarity Score:
45.00%
Best Match:
CHEMBL521986
Prediction Result:
Active72.75%

ACM4_HUMAN

Docking Scores:
-9.28 -8.83
Similarity Score:
44.66%
Best Match:
CHEMBL221753
Prediction Result:
N/A