555 #487 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

CXCR1_HUMAN

Docking Scores:
-4.28
Similarity Score:
10.34%
Best Match:
CHEMBL184637
Prediction Result:
N/A

CXCR2_HUMAN

Docking Scores:
-4.98 -3.67 -3.60
Similarity Score:
10.34%
Best Match:
CHEMBL191413
Prediction Result:
Inactive99.99%

CXCR3_HUMAN

Docking Scores:
-4.81 -4.79 -4.78
Similarity Score:
12.00%
Best Match:
CHEMBL2205723
Prediction Result:
Inactive99.25%

CXCR4_HUMAN

Docking Scores:
-4.76 -3.89 -4.47
Similarity Score:
13.64%
Best Match:
CHEMBL18442
Prediction Result:
N/A

DRD1_HUMAN

Docking Scores:
-4.26 -3.87 -4.24
Similarity Score:
18.18%
Best Match:
CHEMBL441343
Prediction Result:
Inactive99.99%

DRD2_HUMAN

Docking Scores:
-4.96
Similarity Score:
16.67%
Best Match:
CHEMBL59
Prediction Result:
N/A

DRD3_HUMAN

Docking Scores:
-4.12
Similarity Score:
16.67%
Best Match:
CHEMBL59
Prediction Result:
N/A

DRD4_HUMAN

Docking Scores:
-4.43 -4.45
Similarity Score:
16.67%
Best Match:
CHEMBL59
Prediction Result:
N/A

DRD5_HUMAN

Docking Scores:
-4.60 -4.58 -4.61
Similarity Score:
16.67%
Best Match:
CHEMBL59
Prediction Result:
Inactive79.96%

EDNRA_HUMAN

Docking Scores:
-4.68 -4.70 -4.76
Similarity Score:
9.38%
Best Match:
CHEMBL290026
Prediction Result:
Inactive95.54%

GABR1_HUMAN

Docking Scores:
-4.52 -4.64 -5.81
Similarity Score:
5.94%
Best Match:
CHEMBL2391908
Prediction Result:
Inactive84.83%

GASR_HUMAN

Docking Scores:
-4.33 -4.43 -3.14
Similarity Score:
7.50%
Best Match:
CHEMBL38874
Prediction Result:
Inactive99.99%

GRM1_HUMAN

Docking Scores:
-4.56 -4.80 -4.73
Similarity Score:
8.82%
Best Match:
CHEMBL254372
Prediction Result:
Inactive97.68%

GRM2_HUMAN

Docking Scores:
-5.08 -5.43 -5.09
Similarity Score:
10.91%
Best Match:
CHEMBL2112585
Prediction Result:
Inactive84.12%

GRM3_HUMAN

Docking Scores:
-5.18 -5.38 -5.04
Similarity Score:
10.91%
Best Match:
CHEMBL2112584
Prediction Result:
Active56.86%

GRM4_HUMAN

Docking Scores:
-4.32 -4.12 -4.36
Similarity Score:
8.96%
Best Match:
CHEMBL578358
Prediction Result:
Inactive99.99%

GRM5_HUMAN

Docking Scores:
-4.79 -5.56 -5.54
Similarity Score:
15.00%
Best Match:
CHEMBL371811
Prediction Result:
N/A

GRM6_HUMAN

Docking Scores:
-4.88 -4.86 -4.88
Similarity Score:
5.41%
Best Match:
CHEMBL566136
Prediction Result:
Inactive95.32%

GRM7_HUMAN

Docking Scores:
-4.18 -4.31 -4.72
Similarity Score:
14.63%
Best Match:
CHEMBL1387826
Prediction Result:
Inactive99.99%

GRM8_HUMAN

Docking Scores:
-4.10 -4.43 -4.18
Similarity Score:
9.38%
Best Match:
CHEMBL277475
Prediction Result:
Inactive99.99%