A #486 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

ACM5_HUMAN

Docking Scores:
-9.70 -10.42 -9.29
Similarity Score:
43.80%
Best Match:
CHEMBL1090094
Prediction Result:
Active78.77%

ACTHR_HUMAN

Docking Scores:
-9.43 -9.60 -7.70
Similarity Score:
N/A
Best Match:
N/A
Prediction Result:
N/A

ADA1D_HUMAN

Docking Scores:
-9.01 -8.31 -9.13
Similarity Score:
73.91%
Best Match:
CHEMBL56438
Prediction Result:
Active86.03%

ADA2A_HUMAN

Docking Scores:
2.98 4.62 4.61
Similarity Score:
45.61%
Best Match:
CHEMBL1221593
Prediction Result:
Inactive99.99%

ADA2B_HUMAN

Docking Scores:
-9.67 -8.11 -7.17
Similarity Score:
40.38%
Best Match:
CHEMBL51358
Prediction Result:
Active62.86%

ADA2C_HUMAN

Docking Scores:
2.50 6.87 10.71
Similarity Score:
42.96%
Best Match:
CHEMBL1112
Prediction Result:
Inactive99.99%

ADRB1_HUMAN

Docking Scores:
-9.70 -9.73 -9.26
Similarity Score:
61.54%
Best Match:
CHEMBL1424807
Prediction Result:
Active86.61%

ADRB2_HUMAN

Docking Scores:
-8.20 -8.89 -9.26
Similarity Score:
54.95%
Best Match:
CHEMBL417709
Prediction Result:
N/A

ADRB3_HUMAN

Docking Scores:
-9.87 -10.24 -9.72
Similarity Score:
39.45%
Best Match:
CHEMBL155072
Prediction Result:
N/A

AGTR2_HUMAN

Docking Scores:
-8.86 -9.19 -8.81
Similarity Score:
38.21%
Best Match:
CHEMBL290829
Prediction Result:
N/A

BKRB2_HUMAN

Docking Scores:
-10.03 -10.08 -10.06
Similarity Score:
52.25%
Best Match:
CHEMBL110652
Prediction Result:
Active89.32%

CALCR_HUMAN

Docking Scores:
-8.18 -8.25 -8.39
Similarity Score:
30.95%
Best Match:
CHEMBL4462020
Prediction Result:
Inactive98.39%

CCKAR_HUMAN

Docking Scores:
-7.99 -7.97 -8.63
Similarity Score:
45.74%
Best Match:
CHEMBL357983
Prediction Result:
Inactive88.31%

CCR1_HUMAN

Docking Scores:
-8.25 -8.71 -8.22
Similarity Score:
61.70%
Best Match:
CHEMBL2398758
Prediction Result:
Active53.64%

CCR2_HUMAN

Docking Scores:
-8.48 -9.05 -8.31
Similarity Score:
57.84%
Best Match:
CHEMBL2036748
Prediction Result:
Active88.79%

CCR4_HUMAN

Docking Scores:
-7.72 -7.85 -9.10
Similarity Score:
38.31%
Best Match:
CHEMBL600805
Prediction Result:
Inactive61.18%

CCR5_HUMAN

Docking Scores:
-8.13 -7.93 -8.62
Similarity Score:
53.51%
Best Match:
CHEMBL3398002
Prediction Result:
Inactive80.89%

CLTR1_HUMAN

Docking Scores:
-8.87 -9.62 -9.28
Similarity Score:
23.28%
Best Match:
CHEMBL3342954
Prediction Result:
Inactive83.33%

CNR1_HUMAN

Docking Scores:
-8.78 -9.12 -10.19
Similarity Score:
59.26%
Best Match:
CHEMBL3799603
Prediction Result:
N/A

CNR2_HUMAN

Docking Scores:
-9.12 -9.85
Similarity Score:
51.00%
Best Match:
CHEMBL2338177
Prediction Result:
N/A