Fentanyl #58 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
CXCR1_HUMAN

Docking Scores:
-5.19
Similarity Score:
31.10%
Best Match:
CHEMBL561812
Prediction Result:
N/A

CXCR2_HUMAN

Docking Scores:
-8.39 -7.15 -7.38
Similarity Score:
33.87%
Best Match:
CHEMBL392181
Prediction Result:
Inactive70.74%

CXCR3_HUMAN

Docking Scores:
-8.35 -9.08 -8.36
Similarity Score:
54.55%
Best Match:
CHEMBL252503
Prediction Result:
Inactive65.13%

CXCR4_HUMAN

Docking Scores:
-7.98 -6.61 -7.56
Similarity Score:
41.88%
Best Match:
CHEMBL2371850
Prediction Result:
N/A

DRD1_HUMAN

Docking Scores:
-8.59 -8.19 -8.69
Similarity Score:
50.00%
Best Match:
CHEMBL476108
Prediction Result:
Active68.59%

DRD2_HUMAN

Docking Scores:
-7.60
Similarity Score:
70.79%
Best Match:
CHEMBL4091231
Prediction Result:
N/A

DRD3_HUMAN

Docking Scores:
-8.25
Similarity Score:
70.79%
Best Match:
CHEMBL4091231
Prediction Result:
N/A

DRD4_HUMAN

Docking Scores:
-8.89 -8.94
Similarity Score:
70.79%
Best Match:
CHEMBL4074104
Prediction Result:
N/A

DRD5_HUMAN

Docking Scores:
-8.29 -9.41 -8.16
Similarity Score:
52.25%
Best Match:
CHEMBL394080
Prediction Result:
Active82.89%

EDNRA_HUMAN

Docking Scores:
-7.71 -7.61 -7.60
Similarity Score:
38.19%
Best Match:
CHEMBL1793932
Prediction Result:
Active54.42%

GABR1_HUMAN

Docking Scores:
-4.61 -5.28 3.34
Similarity Score:
21.48%
Best Match:
CHEMBL392394
Prediction Result:
Inactive99.99%

GASR_HUMAN

Docking Scores:
-8.39 -8.17 -6.35
Similarity Score:
50.00%
Best Match:
CHEMBL331929
Prediction Result:
Inactive61.79%

GRM1_HUMAN

Docking Scores:
-8.89 -9.87 -7.87
Similarity Score:
61.11%
Best Match:
CHEMBL2418383
Prediction Result:
Active71.16%

GRM2_HUMAN

Docking Scores:
-5.34 -4.15 -5.71
Similarity Score:
45.92%
Best Match:
CHEMBL3221831
Prediction Result:
Inactive99.99%

GRM3_HUMAN

Docking Scores:
-6.22 -7.46 -7.33
Similarity Score:
34.82%
Best Match:
CHEMBL4095995
Prediction Result:
Inactive85.17%

GRM4_HUMAN

Docking Scores:
-0.71 -0.77 -1.35
Similarity Score:
43.62%
Best Match:
CHEMBL578358
Prediction Result:
Inactive99.99%

GRM5_HUMAN

Docking Scores:
-8.50 -6.98 -7.52
Similarity Score:
47.52%
Best Match:
CHEMBL2338572
Prediction Result:
N/A

GRM6_HUMAN

Docking Scores:
-5.95 -8.90 -6.14
Similarity Score:
41.67%
Best Match:
CHEMBL2418359
Prediction Result:
Inactive96.28%

GRM7_HUMAN

Docking Scores:
-4.32 -2.31 -3.24
Similarity Score:
30.14%
Best Match:
CHEMBL3559748
Prediction Result:
Inactive99.99%

GRM8_HUMAN

Docking Scores:
-3.84 -1.22 -2.73
Similarity Score:
41.67%
Best Match:
CHEMBL2418359
Prediction Result:
Inactive99.99%