LTJv1 #74 Output Download CSV

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

Docking Scores:
-9.05 -9.24 -8.62
Similarity Score:
38.72%
Best Match:
CHEMBL4074753

L: Morphine
MTOR_HUMAN

Docking Scores:
-8.61 -8.56 -8.39
Similarity Score:
33.33%
Best Match:
CHEMBL4074753

L: Methadone
MTOR_HUMAN

Docking Scores:
-9.13 -8.57 -9.17
Similarity Score:
31.91%
Best Match:
CHEMBL3972399

L: Pethidine
MTOR_HUMAN

Docking Scores:
-7.81 -7.74 -7.50
Similarity Score:
40.82%
Best Match:
CHEMBL3972399

L: Fentanyl
MTOR_HUMAN

Docking Scores:
-9.53 -9.08 -8.99
Similarity Score:
39.01%
Best Match:
CHEMBL592619

L: Oxycodone
NEP_HUMAN

Docking Scores:
-7.50 -7.64 -7.35
Similarity Score:
49.15%
Best Match:
CHEMBL2062138

L: Morphine
NEP_HUMAN

Docking Scores:
-7.99 -8.13 -7.65
Similarity Score:
38.24%
Best Match:
CHEMBL2062138

L: Methadone
NEP_HUMAN

Docking Scores:
-6.04 -6.05 -6.12
Similarity Score:
57.69%
Best Match:
CHEMBL213404

L: Pethidine
NEP_HUMAN

Docking Scores:
-6.81 -6.24 -5.70
Similarity Score:
52.22%
Best Match:
CHEMBL213404

L: Fentanyl
NEP_HUMAN

Docking Scores:
-7.50 -7.21 -7.56
Similarity Score:
50.00%
Best Match:
CHEMBL467602

L: Oxycodone
NK1R_HUMAN

Docking Scores:
-8.72 -8.75 -7.67
Similarity Score:
48.07%
Best Match:
CHEMBL2112368

L: Morphine
NK1R_HUMAN

Docking Scores:
-8.85 -7.66 -7.99
Similarity Score:
45.41%
Best Match:
CHEMBL2114439

L: Methadone
NK1R_HUMAN

Docking Scores:
-7.99 -7.56 -7.63
Similarity Score:
61.84%
Best Match:
CHEMBL1817817

L: Pethidine
NK1R_HUMAN

Docking Scores:
-7.48 -7.14 -6.92
Similarity Score:
69.14%
Best Match:
CHEMBL277918

L: Fentanyl
NK1R_HUMAN

Docking Scores:
-8.76 -8.19 -7.69
Similarity Score:
63.92%
Best Match:
CHEMBL89245

L: Oxycodone
NMDE1_HUMAN

Docking Scores:
-8.98 -7.84 -7.67
Similarity Score:
24.02%
Best Match:
CHEMBL284237

L: Morphine
NMDE1_HUMAN

Docking Scores:
-7.54 -7.57 -7.47
Similarity Score:
25.65%
Best Match:
CHEMBL284237

L: Methadone
NMDE1_HUMAN

Docking Scores:
-6.88 -6.84 -6.85
Similarity Score:
34.04%
Best Match:
CHEMBL284237

L: Pethidine
NMDE1_HUMAN

Docking Scores:
-8.18 -7.75 -7.39
Similarity Score:
26.13%
Best Match:
CHEMBL284237

L: Fentanyl
NMDE1_HUMAN

Docking Scores:
-8.31 -7.38 -7.70
Similarity Score:
28.44%
Best Match:
CHEMBL284237