test4 #299 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Morphine
COLI_HUMAN

Docking Scores:
-8.58 -8.42 -7.31
Similarity Score:
N/A
Best Match:
N/A

L: Acetaminophen
COLI_HUMAN

Docking Scores:
-5.99 -5.90 -5.86
Similarity Score:
N/A
Best Match:
N/A

L: Diclophenac
COLI_HUMAN

Docking Scores:
-7.40 -7.19 -7.23
Similarity Score:
N/A
Best Match:
N/A

L: Fentanyl
COLI_HUMAN

Docking Scores:
-8.18 -7.94 -7.52
Similarity Score:
N/A
Best Match:
N/A

L: Morphine
COMT_HUMAN

Docking Scores:
-6.97 -6.75 -6.88
Similarity Score:
22.70%
Best Match:
CHEMBL3819488

L: Acetaminophen
COMT_HUMAN

Docking Scores:
-4.92 -4.82 -5.02
Similarity Score:
28.57%
Best Match:
CHEMBL3818719

L: Diclophenac
COMT_HUMAN

Docking Scores:
-6.26 -6.12 -6.36
Similarity Score:
22.76%
Best Match:
CHEMBL1324

L: Fentanyl
COMT_HUMAN

Docking Scores:
-5.90 -6.36 -5.94
Similarity Score:
25.74%
Best Match:
CHEMBL3425731

L: Morphine
CRP_HUMAN

Docking Scores:
-6.73 -6.46
Similarity Score:
N/A
Best Match:
N/A

L: Acetaminophen
CRP_HUMAN

Docking Scores:
-4.82 -5.01
Similarity Score:
N/A
Best Match:
N/A

L: Diclophenac
CRP_HUMAN

Docking Scores:
-5.84 -5.77
Similarity Score:
N/A
Best Match:
N/A

L: Fentanyl
CRP_HUMAN

Docking Scores:
-6.37 -5.93
Similarity Score:
N/A
Best Match:
N/A

L: Morphine
CXCR1_HUMAN

Docking Scores:
-9.65
Similarity Score:
28.19%
Best Match:
CHEMBL490688

L: Acetaminophen
CXCR1_HUMAN

Docking Scores:
-6.41
Similarity Score:
50.79%
Best Match:
CHEMBL184637

L: Diclophenac
CXCR1_HUMAN

Docking Scores:
-7.66
Similarity Score:
100.00%
Best Match:
CHEMBL139

L: Fentanyl
CXCR1_HUMAN

Docking Scores:
-5.19
Similarity Score:
31.10%
Best Match:
CHEMBL561812

L: Morphine
CXCR4_HUMAN

Docking Scores:
-8.67 -7.31 -8.11
Similarity Score:
33.92%
Best Match:
CHEMBL2029611

L: Acetaminophen
CXCR4_HUMAN

Docking Scores:
-6.73 -5.63 -5.82
Similarity Score:
29.33%
Best Match:
CHEMBL2347630

L: Diclophenac
CXCR4_HUMAN

Docking Scores:
-7.70 -6.68 -7.09
Similarity Score:
28.18%
Best Match:
CHEMBL3908835

L: Fentanyl
CXCR4_HUMAN

Docking Scores:
-7.98 -6.61 -7.56
Similarity Score:
41.88%
Best Match:
CHEMBL2371850