LTJ #73 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Dihydrocodeine
PDE4B_HUMAN

Docking Scores:
-9.13 -8.10 -9.60
Similarity Score:
58.90%
Best Match:
CHEMBL144499

L: Acetylsalicylic acid
PDE4B_HUMAN

Docking Scores:
-6.36 -7.14 -7.15
Similarity Score:
32.69%
Best Match:
CHEMBL2172710

L: Hydromorphone
PDE4B_HUMAN

Docking Scores:
-8.12 -8.51 -8.88
Similarity Score:
61.90%
Best Match:
CHEMBL144499

L: Ibuprofen
PDE4B_HUMAN

Docking Scores:
-7.37 -7.59 -7.75
Similarity Score:
31.68%
Best Match:
CHEMBL3315269

L: Codeine
PDE4B_HUMAN

Docking Scores:
-8.37 -7.91 -8.55
Similarity Score:
46.49%
Best Match:
CHEMBL144499

L: Dihydrocodeine
PDE5A_HUMAN

Docking Scores:
-8.17 -8.47 -9.49
Similarity Score:
36.36%
Best Match:
CHEMBL190423

L: Acetylsalicylic acid
PDE5A_HUMAN

Docking Scores:
-6.61 -6.38 -6.44
Similarity Score:
40.57%
Best Match:
CHEMBL363889

L: Hydromorphone
PDE5A_HUMAN

Docking Scores:
-8.55 -8.42 -8.25
Similarity Score:
38.20%
Best Match:
CHEMBL190423

L: Ibuprofen
PDE5A_HUMAN

Docking Scores:
-7.69 -7.38 -7.24
Similarity Score:
22.94%
Best Match:
CHEMBL362755

L: Codeine
PDE5A_HUMAN

Docking Scores:
-7.80 -8.28 -8.12
Similarity Score:
32.23%
Best Match:
CHEMBL190423

L: Dihydrocodeine
PERM_HUMAN

Docking Scores:
-8.26 -8.48 -8.58
Similarity Score:
43.31%
Best Match:
CHEMBL490

L: Acetylsalicylic acid
PERM_HUMAN

Docking Scores:
-6.04 -7.00 -5.98
Similarity Score:
38.24%
Best Match:
CHEMBL309339

L: Hydromorphone
PERM_HUMAN

Docking Scores:
-8.21 -8.60 -8.53
Similarity Score:
40.00%
Best Match:
CHEMBL490

L: Ibuprofen
PERM_HUMAN

Docking Scores:
-6.67 -6.65 -6.70
Similarity Score:
32.35%
Best Match:
CHEMBL3892909

L: Codeine
PERM_HUMAN

Docking Scores:
-8.20 -8.53 -8.29
Similarity Score:
35.38%
Best Match:
CHEMBL490

L: Dihydrocodeine
PGH1_SHEEP

Docking Scores:
-5.20 -7.48 -8.24
Similarity Score:
34.71%
Best Match:
CHEMBL229957

L: Acetylsalicylic acid
PGH1_SHEEP

Docking Scores:
-6.16 -6.65 -6.06
Similarity Score:
100.00%
Best Match:
CHEMBL25

L: Hydromorphone
PGH1_SHEEP

Docking Scores:
-4.04 -6.34 -7.12
Similarity Score:
33.96%
Best Match:
CHEMBL24798

L: Ibuprofen
PGH1_SHEEP

Docking Scores:
-7.27 -7.29 -7.36
Similarity Score:
100.00%
Best Match:
CHEMBL175

L: Codeine
PGH1_SHEEP

Docking Scores:
-3.68 -7.33 -6.64
Similarity Score:
35.35%
Best Match:
CHEMBL229957