LTJv1 #74 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Oxycodone
MDR1_HUMAN

Docking Scores:
-8.39 -7.90
Similarity Score:
74.67%
Best Match:
CHEMBL261048

L: Morphine
MDR1_HUMAN

Docking Scores:
-8.83 -7.65
Similarity Score:
100.00%
Best Match:
CHEMBL70

L: Methadone
MDR1_HUMAN

Docking Scores:
-6.80 -7.59
Similarity Score:
62.12%
Best Match:
CHEMBL21731

L: Pethidine
MDR1_HUMAN

Docking Scores:
-6.78 -6.65
Similarity Score:
63.41%
Best Match:
CHEMBL914

L: Fentanyl
MDR1_HUMAN

Docking Scores:
-7.93 -8.39
Similarity Score:
46.34%
Best Match:
CHEMBL2398178

L: Oxycodone
MIF_HUMAN

Docking Scores:
-6.02 -7.40 -6.57
Similarity Score:
28.08%
Best Match:
CHEMBL1289631

L: Morphine
MIF_HUMAN

Docking Scores:
-5.89 -6.62 -6.86
Similarity Score:
30.43%
Best Match:
CHEMBL2375651

L: Methadone
MIF_HUMAN

Docking Scores:
-6.65 -7.09 -6.12
Similarity Score:
26.83%
Best Match:
CHEMBL209588

L: Pethidine
MIF_HUMAN

Docking Scores:
-5.61 -6.49 -5.95
Similarity Score:
30.43%
Best Match:
CHEMBL497598

L: Fentanyl
MIF_HUMAN

Docking Scores:
-8.01 -8.45 -7.18
Similarity Score:
25.78%
Best Match:
CHEMBL1604170

L: Oxycodone
MK01_HUMAN

Docking Scores:
-7.99 -8.51 -7.32
Similarity Score:
40.23%
Best Match:
CHEMBL3752989

L: Morphine
MK01_HUMAN

Docking Scores:
-6.84 -7.84 -7.38
Similarity Score:
39.53%
Best Match:
CHEMBL555017

L: Methadone
MK01_HUMAN

Docking Scores:
-6.30 -6.75 -6.49
Similarity Score:
39.62%
Best Match:
CHEMBL3752989

L: Pethidine
MK01_HUMAN

Docking Scores:
-6.49 -6.37 -5.87
Similarity Score:
40.87%
Best Match:
CHEMBL3752989

L: Fentanyl
MK01_HUMAN

Docking Scores:
-7.20 -7.37 -7.83
Similarity Score:
47.06%
Best Match:
CHEMBL3356128

L: Oxycodone
MK03_HUMAN

Docking Scores:
-8.18 -8.27 -7.74
Similarity Score:
34.65%
Best Match:
CHEMBL555017

L: Morphine
MK03_HUMAN

Docking Scores:
-6.29 -6.63 -7.60
Similarity Score:
39.53%
Best Match:
CHEMBL555017

L: Methadone
MK03_HUMAN

Docking Scores:
-5.80 -7.24 -6.86
Similarity Score:
33.04%
Best Match:
CHEMBL3113587

L: Pethidine
MK03_HUMAN

Docking Scores:
-7.16 -6.64 -6.12
Similarity Score:
33.61%
Best Match:
CHEMBL3113587

L: Fentanyl
MK03_HUMAN

Docking Scores:
-7.90 -8.11 -8.19
Similarity Score:
38.14%
Best Match:
CHEMBL3113587