sinomenine #467 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

5HT1A_HUMAN

Docking Scores:
-8.05 -7.34 -8.59
Similarity Score:
55.26%
Best Match:
CHEMBL160096
Prediction Result:
Active54.08%

5HT1B_HUMAN

Docking Scores:
-8.21 -8.38 -7.35
Similarity Score:
50.96%
Best Match:
CHEMBL29951
Prediction Result:
N/A

5HT1D_HUMAN

Docking Scores:
-8.32 -6.18 -7.29
Similarity Score:
50.96%
Best Match:
CHEMBL29951
Prediction Result:
N/A

5HT1E_HUMAN

Docking Scores:
-7.80 -6.80 -6.54
Similarity Score:
32.58%
Best Match:
CHEMBL137781
Prediction Result:
Active55.96%

5HT1F_HUMAN

Docking Scores:
-8.81 -8.62 -8.78
Similarity Score:
29.85%
Best Match:
CHEMBL3616488
Prediction Result:
Inactive62.69%

5HT2A_HUMAN

Docking Scores:
-8.05 -8.02
Similarity Score:
53.99%
Best Match:
CHEMBL4206824
Prediction Result:
N/A

5HT2B_HUMAN

Docking Scores:
-8.57 -8.91 -7.81
Similarity Score:
45.83%
Best Match:
CHEMBL4472703
Prediction Result:
N/A

5HT2C_HUMAN

Docking Scores:
-7.86 -7.39
Similarity Score:
46.67%
Best Match:
CHEMBL155388
Prediction Result:
N/A

5HT4R_HUMAN

Docking Scores:
-8.38 -8.74 -7.64
Similarity Score:
40.33%
Best Match:
CHEMBL4580044
Prediction Result:
Inactive64.98%

5HT5A_HUMAN

Docking Scores:
-8.71 -7.70 -8.24
Similarity Score:
51.02%
Best Match:
CHEMBL278751
Prediction Result:
Inactive54.96%

5HT6R_HUMAN

Docking Scores:
-7.70 -7.71 -8.24
Similarity Score:
40.10%
Best Match:
CHEMBL464099
Prediction Result:
Active65.92%

5HT7R_HUMAN

Docking Scores:
-9.01 -8.52 -7.52
Similarity Score:
47.34%
Best Match:
CHEMBL70048
Prediction Result:
Active64.17%

AA1R_HUMAN

Docking Scores:
-7.49 -8.42 -5.99
Similarity Score:
37.70%
Best Match:
CHEMBL1269107
Prediction Result:
N/A

AA2AR_HUMAN

Docking Scores:
-6.15 -6.55 -7.67
Similarity Score:
42.25%
Best Match:
CHEMBL539454
Prediction Result:
N/A

AA2BR_HUMAN

Docking Scores:
-8.23 -8.43 -8.43
Similarity Score:
30.08%
Best Match:
CHEMBL432273
Prediction Result:
Inactive65.72%

AA3R_HUMAN

Docking Scores:
-4.48 -3.02 -7.86
Similarity Score:
30.93%
Best Match:
CHEMBL3601563
Prediction Result:
Inactive99.99%

ACM1_HUMAN

Docking Scores:
-8.85 9.21
Similarity Score:
43.68%
Best Match:
CHEMBL148450
Prediction Result:
N/A

ACM2_HUMAN

Docking Scores:
-9.15 -8.81 -8.19
Similarity Score:
45.70%
Best Match:
CHEMBL4085150
Prediction Result:
Active64.57%

ACM3_HUMAN

Docking Scores:
-8.97 -9.89 -9.13
Similarity Score:
46.00%
Best Match:
CHEMBL4075227
Prediction Result:
Active53.67%

ACM4_HUMAN

Docking Scores:
-7.76 -6.03
Similarity Score:
43.23%
Best Match:
CHEMBL1101
Prediction Result:
N/A