abct #375 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

ACM5_HUMAN

Docking Scores:
-7.36 -7.30 -7.45
Similarity Score:
26.00%
Best Match:
CHEMBL657
Prediction Result:
Active57.50%

ACTHR_HUMAN

Docking Scores:
-9.16 -8.89 -7.29
Similarity Score:
N/A
Best Match:
N/A
Prediction Result:
N/A

ADA1D_HUMAN

Docking Scores:
-6.65 -6.63 -6.59
Similarity Score:
25.00%
Best Match:
CHEMBL648
Prediction Result:
Active51.19%

ADA2A_HUMAN

Docking Scores:
-7.77 -7.36 -5.54
Similarity Score:
29.27%
Best Match:
CHEMBL61006
Prediction Result:
Active69.10%

ADA2B_HUMAN

Docking Scores:
-8.30 -8.10 -7.79
Similarity Score:
26.09%
Best Match:
CHEMBL972
Prediction Result:
Active54.50%

ADA2C_HUMAN

Docking Scores:
-4.90 -4.83 -4.91
Similarity Score:
24.00%
Best Match:
CHEMBL1437
Prediction Result:
Inactive54.49%

ADRB1_HUMAN

Docking Scores:
-6.98 -7.45 -7.43
Similarity Score:
30.51%
Best Match:
CHEMBL1621144
Prediction Result:
Active61.67%

ADRB2_HUMAN

Docking Scores:
-6.98 -8.16 -7.85
Similarity Score:
33.96%
Best Match:
CHEMBL4062049
Prediction Result:
N/A

ADRB3_HUMAN

Docking Scores:
-7.68 -8.23 -7.62
Similarity Score:
29.03%
Best Match:
CHEMBL507003
Prediction Result:
N/A

AGTR2_HUMAN

Docking Scores:
-7.50 -7.70 -7.55
Similarity Score:
16.36%
Best Match:
CHEMBL290286
Prediction Result:
N/A

BKRB2_HUMAN

Docking Scores:
-7.13 -7.93 -7.54
Similarity Score:
18.75%
Best Match:
CHEMBL121565
Prediction Result:
Inactive92.96%

CALCR_HUMAN

Docking Scores:
-6.80 -6.58 -6.82
Similarity Score:
8.16%
Best Match:
CHEMBL2369895
Prediction Result:
Inactive97.34%

CCKAR_HUMAN

Docking Scores:
-7.07 -6.95 -7.95
Similarity Score:
16.67%
Best Match:
CHEMBL1210154
Prediction Result:
Inactive98.80%

CCR1_HUMAN

Docking Scores:
-7.70 -8.08 -6.61
Similarity Score:
21.43%
Best Match:
CHEMBL2205805
Prediction Result:
Inactive98.29%

CCR2_HUMAN

Docking Scores:
-7.13 -6.85 -6.50
Similarity Score:
24.00%
Best Match:
CHEMBL18442
Prediction Result:
Inactive97.24%

CCR4_HUMAN

Docking Scores:
-5.94 -6.33 -6.91
Similarity Score:
15.79%
Best Match:
CHEMBL1618631
Prediction Result:
Inactive89.25%

CCR5_HUMAN

Docking Scores:
-6.78 -6.81 -7.00
Similarity Score:
22.22%
Best Match:
CHEMBL106264
Prediction Result:
Inactive99.74%

CLTR1_HUMAN

Docking Scores:
-6.84 -7.46 -8.01
Similarity Score:
13.85%
Best Match:
CHEMBL33329
Prediction Result:
Inactive96.95%

CNR1_HUMAN

Docking Scores:
-7.22 -7.43 -8.22
Similarity Score:
37.50%
Best Match:
CHEMBL3915185
Prediction Result:
N/A

CNR2_HUMAN

Docking Scores:
-8.21 -8.33
Similarity Score:
38.30%
Best Match:
CHEMBL32362
Prediction Result:
N/A