ACTE #54 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

CXCR1_HUMAN

Docking Scores:
-5.63
Similarity Score:
4.92%
Best Match:
CHEMBL191413
Prediction Result:
N/A

CXCR2_HUMAN

Docking Scores:
-5.30 -4.49 -4.09
Similarity Score:
5.13%
Best Match:
CHEMBL4103634
Prediction Result:
Inactive99.99%

CXCR3_HUMAN

Docking Scores:
-5.20 -5.11 -5.13
Similarity Score:
12.00%
Best Match:
CHEMBL2205723
Prediction Result:
Inactive99.32%

CXCR4_HUMAN

Docking Scores:
-5.38 -3.98 -4.66
Similarity Score:
10.00%
Best Match:
CHEMBL2170299
Prediction Result:
N/A

DRD1_HUMAN

Docking Scores:
-5.55 -4.69 -4.87
Similarity Score:
11.32%
Best Match:
CHEMBL21731
Prediction Result:
Inactive78.18%

DRD2_HUMAN

Docking Scores:
-5.63
Similarity Score:
11.54%
Best Match:
CHEMBL162762
Prediction Result:
N/A

DRD3_HUMAN

Docking Scores:
-5.30
Similarity Score:
13.04%
Best Match:
CHEMBL1123
Prediction Result:
N/A

DRD4_HUMAN

Docking Scores:
-5.45 -5.59
Similarity Score:
11.54%
Best Match:
CHEMBL162762
Prediction Result:
N/A

DRD5_HUMAN

Docking Scores:
-5.13 -5.40 -5.53
Similarity Score:
11.32%
Best Match:
CHEMBL21731
Prediction Result:
Inactive84.81%

EDNRA_HUMAN

Docking Scores:
-5.42 -5.36 -4.36
Similarity Score:
6.85%
Best Match:
CHEMBL286808
Prediction Result:
Inactive96.12%

GABR1_HUMAN

Docking Scores:
-5.45 -5.62 -6.38
Similarity Score:
5.94%
Best Match:
CHEMBL2391908
Prediction Result:
Inactive91.34%

GASR_HUMAN

Docking Scores:
-4.97 -4.82 -4.42
Similarity Score:
6.59%
Best Match:
CHEMBL537171
Prediction Result:
Inactive96.81%

GRM1_HUMAN

Docking Scores:
-6.25 -6.04 -5.79
Similarity Score:
11.32%
Best Match:
CHEMBL1270719
Prediction Result:
Inactive94.97%

GRM2_HUMAN

Docking Scores:
-6.84 -6.73 -6.91
Similarity Score:
18.75%
Best Match:
CHEMBL482081
Prediction Result:
Inactive80.54%

GRM3_HUMAN

Docking Scores:
-6.86 -6.67 -6.66
Similarity Score:
17.14%
Best Match:
CHEMBL2112586
Prediction Result:
Inactive65.37%

GRM4_HUMAN

Docking Scores:
-4.71 -4.27 -3.91
Similarity Score:
8.96%
Best Match:
CHEMBL578358
Prediction Result:
Inactive99.99%

GRM5_HUMAN

Docking Scores:
-5.83 -6.45 -6.39
Similarity Score:
17.65%
Best Match:
CHEMBL1783985
Prediction Result:
N/A

GRM6_HUMAN

Docking Scores:
-6.01 -5.99 -5.93
Similarity Score:
15.15%
Best Match:
CHEMBL280563
Prediction Result:
Inactive93.35%

GRM7_HUMAN

Docking Scores:
-5.50 -5.13 -5.56
Similarity Score:
6.90%
Best Match:
CHEMBL432038
Prediction Result:
Inactive99.97%

GRM8_HUMAN

Docking Scores:
-5.00 -4.90 -4.20
Similarity Score:
15.15%
Best Match:
CHEMBL280563
Prediction Result:
Inactive99.99%