chenyan1 #43 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

ACM5_HUMAN

Docking Scores:
-10.78 -9.74 -11.43
Similarity Score:
37.93%
Best Match:
CHEMBL296419
Prediction Result:
Active82.12%

ACTHR_HUMAN

Docking Scores:
-11.97 -10.95 -8.54
Similarity Score:
N/A
Best Match:
N/A
Prediction Result:
N/A

ADA1D_HUMAN

Docking Scores:
-10.81 -9.85 -10.97
Similarity Score:
38.92%
Best Match:
CHEMBL3809093
Prediction Result:
Active61.22%

ADA2A_HUMAN

Docking Scores:
12.32 15.20 18.65
Similarity Score:
36.67%
Best Match:
CHEMBL218730
Prediction Result:
Inactive99.99%

ADA2B_HUMAN

Docking Scores:
-12.71 -12.13 -11.63
Similarity Score:
36.67%
Best Match:
CHEMBL218730
Prediction Result:
Inactive55.49%

ADA2C_HUMAN

Docking Scores:
31.22 32.47 8.88
Similarity Score:
37.93%
Best Match:
CHEMBL296419
Prediction Result:
Inactive99.99%

ADRB1_HUMAN

Docking Scores:
-10.98 -11.78 -11.74
Similarity Score:
45.89%
Best Match:
CHEMBL467298
Prediction Result:
Inactive66.01%

ADRB2_HUMAN

Docking Scores:
-10.16 -9.78 -11.94
Similarity Score:
40.54%
Best Match:
CHEMBL461463
Prediction Result:
N/A

ADRB3_HUMAN

Docking Scores:
-10.80 -12.12 -10.81
Similarity Score:
40.29%
Best Match:
CHEMBL467103
Prediction Result:
N/A

AGTR2_HUMAN

Docking Scores:
-10.00 -10.59 -11.64
Similarity Score:
38.53%
Best Match:
CHEMBL40381
Prediction Result:
N/A

BKRB2_HUMAN

Docking Scores:
-11.85 -12.21 -11.72
Similarity Score:
44.68%
Best Match:
CHEMBL544623
Prediction Result:
Active63.85%

CALCR_HUMAN

Docking Scores:
-9.67 -10.41 -9.78
Similarity Score:
27.03%
Best Match:
CHEMBL2369897
Prediction Result:
Inactive97.68%

CCKAR_HUMAN

Docking Scores:
-9.45 -8.96 -9.48
Similarity Score:
43.64%
Best Match:
CHEMBL479030
Prediction Result:
Inactive54.90%

CCR1_HUMAN

Docking Scores:
-10.50 -9.02 -9.45
Similarity Score:
36.62%
Best Match:
CHEMBL1784685
Prediction Result:
Active54.41%

CCR2_HUMAN

Docking Scores:
-9.06 -9.50 -9.33
Similarity Score:
37.14%
Best Match:
CHEMBL2018534
Prediction Result:
Inactive53.00%

CCR4_HUMAN

Docking Scores:
-8.89 -9.28 -10.12
Similarity Score:
36.36%
Best Match:
CHEMBL2435852
Prediction Result:
Active58.88%

CCR5_HUMAN

Docking Scores:
-9.86 -9.35 -9.47
Similarity Score:
37.50%
Best Match:
CHEMBL499109
Prediction Result:
Inactive52.73%

CLTR1_HUMAN

Docking Scores:
-10.11 -11.33 -12.17
Similarity Score:
41.78%
Best Match:
CHEMBL1214532
Prediction Result:
Active72.44%

CNR1_HUMAN

Docking Scores:
-9.47 -10.37 -9.45
Similarity Score:
42.50%
Best Match:
CHEMBL1224370
Prediction Result:
N/A

CNR2_HUMAN

Docking Scores:
-12.83 -12.61
Similarity Score:
46.43%
Best Match:
CHEMBL471992
Prediction Result:
N/A