LTJv1 #74 Output Download CSV

View All
Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Oxycodone
CNR2_HUMAN

Docking Scores:
-8.87 -9.55
Similarity Score:
53.16%
Best Match:
CHEMBL223990

L: Morphine
CNR2_HUMAN

Docking Scores:
-9.81 -9.01
Similarity Score:
56.82%
Best Match:
CHEMBL303479

L: Methadone
CNR2_HUMAN

Docking Scores:
-8.71 -8.28
Similarity Score:
61.76%
Best Match:
CHEMBL478624

L: Pethidine
CNR2_HUMAN

Docking Scores:
-7.68 -8.10
Similarity Score:
52.69%
Best Match:
CHEMBL1765274

L: Fentanyl
CNR2_HUMAN

Docking Scores:
-9.18 -9.97
Similarity Score:
70.11%
Best Match:
CHEMBL2338188

L: Oxycodone
COLI_HUMAN

Docking Scores:
-8.01 -8.17 -7.46
Similarity Score:
N/A
Best Match:
N/A

L: Morphine
COLI_HUMAN

Docking Scores:
-7.69 -7.95 -6.85
Similarity Score:
N/A
Best Match:
N/A

L: Methadone
COLI_HUMAN

Docking Scores:
-7.25 -7.06 -6.04
Similarity Score:
N/A
Best Match:
N/A

L: Pethidine
COLI_HUMAN

Docking Scores:
-6.92 -6.54 -5.65
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: Oxycodone
COMT_HUMAN

Docking Scores:
-5.86 -5.75 -5.72
Similarity Score:
25.55%
Best Match:
CHEMBL3425740

L: Morphine
COMT_HUMAN

Docking Scores:
-6.47 -6.72 -5.80
Similarity Score:
22.70%
Best Match:
CHEMBL3819488

L: Methadone
COMT_HUMAN

Docking Scores:
-5.40 -5.45 -5.17
Similarity Score:
28.69%
Best Match:
CHEMBL3425731

L: Pethidine
COMT_HUMAN

Docking Scores:
-5.45 -5.42 -5.22
Similarity Score:
25.74%
Best Match:
CHEMBL3425731

L: Fentanyl
COMT_HUMAN

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

L: Oxycodone
CRP_HUMAN

Docking Scores:
-6.15 -6.24
Similarity Score:
N/A
Best Match:
N/A

L: Morphine
CRP_HUMAN

Docking Scores:
-6.18 -6.46
Similarity Score:
N/A
Best Match:
N/A

L: Methadone
CRP_HUMAN

Docking Scores:
-5.45 -4.83
Similarity Score:
N/A
Best Match:
N/A

L: Pethidine
CRP_HUMAN

Docking Scores:
-4.87 -5.46
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