LTJv1 #74 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

L: Oxycodone
ACHA9_HUMAN

Docking Scores:
-6.73
Similarity Score:
27.39%
Best Match:
CHEMBL386114

L: Morphine
ACHA9_HUMAN

Docking Scores:
-7.15
Similarity Score:
21.72%
Best Match:
CHEMBL386114

L: Methadone
ACHA9_HUMAN

Docking Scores:
-6.98
Similarity Score:
24.85%
Best Match:
CHEMBL386114

L: Pethidine
ACHA9_HUMAN

Docking Scores:
-5.82
Similarity Score:
29.31%
Best Match:
CHEMBL386114

L: Fentanyl
ACHA9_HUMAN

Docking Scores:
-6.45
Similarity Score:
28.57%
Best Match:
CHEMBL386114

L: Oxycodone
ACHB2_HUMAN

Docking Scores:
-5.68 -2.98 -7.00
Similarity Score:
N/A
Best Match:
N/A

L: Morphine
ACHB2_HUMAN

Docking Scores:
-6.01 -3.34 -5.84
Similarity Score:
N/A
Best Match:
N/A

L: Methadone
ACHB2_HUMAN

Docking Scores:
-3.73 -3.15 -6.59
Similarity Score:
N/A
Best Match:
N/A

L: Pethidine
ACHB2_HUMAN

Docking Scores:
-5.46 -6.95 -7.06
Similarity Score:
N/A
Best Match:
N/A

L: Fentanyl
ACHB2_HUMAN

Docking Scores:
-6.17 -6.86 -4.84
Similarity Score:
N/A
Best Match:
N/A

L: Oxycodone
ACM1_HUMAN

Docking Scores:
-10.32 4.58
Similarity Score:
50.00%
Best Match:
CHEMBL343236

L: Morphine
ACM1_HUMAN

Docking Scores:
-10.58 3.64
Similarity Score:
45.66%
Best Match:
CHEMBL343236

L: Methadone
ACM1_HUMAN

Docking Scores:
-8.67 0.67
Similarity Score:
63.51%
Best Match:
CHEMBL2112956

L: Pethidine
ACM1_HUMAN

Docking Scores:
-8.37 -4.81
Similarity Score:
75.90%
Best Match:
CHEMBL3629534

L: Fentanyl
ACM1_HUMAN

Docking Scores:
-8.03 -2.80
Similarity Score:
73.91%
Best Match:
CHEMBL1243110

L: Oxycodone
ACM4_HUMAN

Docking Scores:
-10.21 -6.87
Similarity Score:
48.50%
Best Match:
CHEMBL1346

L: Morphine
ACM4_HUMAN

Docking Scores:
-9.92 -6.06
Similarity Score:
39.27%
Best Match:
CHEMBL1346

L: Methadone
ACM4_HUMAN

Docking Scores:
-8.48 -7.16
Similarity Score:
63.51%
Best Match:
CHEMBL2112956

L: Pethidine
ACM4_HUMAN

Docking Scores:
-8.60 -7.24
Similarity Score:
75.00%
Best Match:
CHEMBL285898

L: Fentanyl
ACM4_HUMAN

Docking Scores:
-8.29 -7.78
Similarity Score:
68.48%
Best Match:
CHEMBL3354065