C64 #40 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

5HT1A_HUMAN

Docking Scores:
-8.50 -8.26 -10.08
Similarity Score:
70.94%
Best Match:
CHEMBL1221452
Prediction Result:
Active93.27%

5HT1B_HUMAN

Docking Scores:
-8.95 -9.41 -9.81
Similarity Score:
53.85%
Best Match:
CHEMBL292759
Prediction Result:
N/A

5HT1D_HUMAN

Docking Scores:
-9.84 -9.08 -8.14
Similarity Score:
53.85%
Best Match:
CHEMBL292759
Prediction Result:
N/A

5HT1E_HUMAN

Docking Scores:
-9.63 -9.12 -8.83
Similarity Score:
39.15%
Best Match:
CHEMBL29410
Prediction Result:
Inactive50.02%

5HT1F_HUMAN

Docking Scores:
-9.40 -9.63 -9.79
Similarity Score:
53.85%
Best Match:
CHEMBL292759
Prediction Result:
Active84.85%

5HT2A_HUMAN

Docking Scores:
-9.27 -9.50
Similarity Score:
70.94%
Best Match:
CHEMBL1221452
Prediction Result:
N/A

5HT2B_HUMAN

Docking Scores:
-8.69 -9.37 -9.02
Similarity Score:
53.85%
Best Match:
CHEMBL292759
Prediction Result:
N/A

5HT2C_HUMAN

Docking Scores:
-9.21 -10.07
Similarity Score:
70.94%
Best Match:
CHEMBL1221452
Prediction Result:
N/A

5HT4R_HUMAN

Docking Scores:
-9.17 -8.96 -8.44
Similarity Score:
42.01%
Best Match:
CHEMBL90559
Prediction Result:
Inactive55.71%

5HT5A_HUMAN

Docking Scores:
-8.60 -7.59 -8.18
Similarity Score:
38.51%
Best Match:
CHEMBL538029
Prediction Result:
Inactive70.41%

5HT6R_HUMAN

Docking Scores:
-8.57 -9.18 -10.05
Similarity Score:
70.94%
Best Match:
CHEMBL1221452
Prediction Result:
Active95.15%

5HT7R_HUMAN

Docking Scores:
-9.43 -9.75 -9.67
Similarity Score:
56.59%
Best Match:
CHEMBL523519
Prediction Result:
Active88.55%

AA1R_HUMAN

Docking Scores:
-9.04 -8.95 -8.78
Similarity Score:
36.36%
Best Match:
CHEMBL1170137
Prediction Result:
N/A

AA2AR_HUMAN

Docking Scores:
-8.56 -8.57 -8.91
Similarity Score:
37.70%
Best Match:
CHEMBL482648
Prediction Result:
N/A

AA2BR_HUMAN

Docking Scores:
-8.91 -8.93 -8.90
Similarity Score:
38.02%
Best Match:
CHEMBL520899
Prediction Result:
Active62.12%

AA3R_HUMAN

Docking Scores:
-6.39 -6.03 -8.98
Similarity Score:
42.49%
Best Match:
CHEMBL603
Prediction Result:
Active58.00%

ACM1_HUMAN

Docking Scores:
-7.90 -0.89
Similarity Score:
50.41%
Best Match:
CHEMBL1455766
Prediction Result:
N/A

ACM2_HUMAN

Docking Scores:
-8.75 -8.30 -8.46
Similarity Score:
50.41%
Best Match:
CHEMBL1713967
Prediction Result:
Active58.42%

ACM3_HUMAN

Docking Scores:
-9.95 -10.42 -9.52
Similarity Score:
53.57%
Best Match:
CHEMBL494778
Prediction Result:
Active83.29%

ACM4_HUMAN

Docking Scores:
-7.72 -8.74
Similarity Score:
50.41%
Best Match:
CHEMBL1455766
Prediction Result:
N/A