LTJ #73 Output Download CSV

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

Docking Scores:
-8.53 -8.64
Similarity Score:
93.08%
Best Match:
CHEMBL258669

L: Acetylsalicylic acid
MDR1_HUMAN

Docking Scores:
-6.01 -5.60
Similarity Score:
42.00%
Best Match:
CHEMBL9352

L: Hydromorphone
MDR1_HUMAN

Docking Scores:
-8.12 -7.69
Similarity Score:
82.35%
Best Match:
CHEMBL261048

L: Ibuprofen
MDR1_HUMAN

Docking Scores:
-6.53 -6.95
Similarity Score:
54.55%
Best Match:
CHEMBL914

L: Codeine
MDR1_HUMAN

Docking Scores:
-8.72 -7.31
Similarity Score:
100.00%
Best Match:
CHEMBL485

L: Dihydrocodeine
MIF_HUMAN

Docking Scores:
-6.23 -7.56 -6.91
Similarity Score:
27.66%
Best Match:
CHEMBL1289631

L: Acetylsalicylic acid
MIF_HUMAN

Docking Scores:
-5.01 -6.21 -5.15
Similarity Score:
32.94%
Best Match:
CHEMBL224086

L: Hydromorphone
MIF_HUMAN

Docking Scores:
-5.80 -6.70 -7.02
Similarity Score:
28.80%
Best Match:
CHEMBL1289631

L: Ibuprofen
MIF_HUMAN

Docking Scores:
-7.81 -7.69 -8.05
Similarity Score:
25.45%
Best Match:
CHEMBL209588

L: Codeine
MIF_HUMAN

Docking Scores:
-6.60 -7.30 -7.13
Similarity Score:
30.33%
Best Match:
CHEMBL2375651

L: Dihydrocodeine
MK01_HUMAN

Docking Scores:
-7.65 -8.66 -7.23
Similarity Score:
36.82%
Best Match:
CHEMBL3654783

L: Acetylsalicylic acid
MK01_HUMAN

Docking Scores:
-5.92 -5.73 -6.23
Similarity Score:
33.33%
Best Match:
CHEMBL2004872

L: Hydromorphone
MK01_HUMAN

Docking Scores:
-7.31 -7.80 -7.58
Similarity Score:
39.39%
Best Match:
CHEMBL3752989

L: Ibuprofen
MK01_HUMAN

Docking Scores:
-6.63 -6.30 -6.59
Similarity Score:
36.84%
Best Match:
CHEMBL1909070

L: Codeine
MK01_HUMAN

Docking Scores:
-6.77 -8.18 -7.26
Similarity Score:
39.92%
Best Match:
CHEMBL555017

L: Dihydrocodeine
MK03_HUMAN

Docking Scores:
-8.50 -7.75 -8.32
Similarity Score:
31.43%
Best Match:
CHEMBL555017

L: Acetylsalicylic acid
MK03_HUMAN

Docking Scores:
-6.05 -6.28 -6.48
Similarity Score:
31.45%
Best Match:
CHEMBL3797548

L: Hydromorphone
MK03_HUMAN

Docking Scores:
-6.73 -7.54 -8.11
Similarity Score:
32.79%
Best Match:
CHEMBL555017

L: Ibuprofen
MK03_HUMAN

Docking Scores:
-7.04 -6.86 -5.94
Similarity Score:
23.58%
Best Match:
CHEMBL3113587

L: Codeine
MK03_HUMAN

Docking Scores:
-6.75 -7.92 -7.85
Similarity Score:
39.92%
Best Match:
CHEMBL555017