LTJ #73 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Dihydrocodeine
CNR2_HUMAN

Docking Scores:
-9.68 -9.20
Similarity Score:
56.05%
Best Match:
CHEMBL3410730

L: Acetylsalicylic acid
CNR2_HUMAN

Docking Scores:
-6.25 -6.47
Similarity Score:
47.83%
Best Match:
CHEMBL243334

L: Hydromorphone
CNR2_HUMAN

Docking Scores:
-9.16 -9.24
Similarity Score:
55.86%
Best Match:
CHEMBL426923

L: Ibuprofen
CNR2_HUMAN

Docking Scores:
-7.61 -7.51
Similarity Score:
55.32%
Best Match:
CHEMBL264412

L: Codeine
CNR2_HUMAN

Docking Scores:
-9.57 -8.98
Similarity Score:
57.39%
Best Match:
CHEMBL303479

L: Dihydrocodeine
COLI_HUMAN

Docking Scores:
-8.16 -8.06 -6.92
Similarity Score:
N/A
Best Match:
N/A

L: Acetylsalicylic acid
COLI_HUMAN

Docking Scores:
-6.37 -6.26 -5.32
Similarity Score:
N/A
Best Match:
N/A

L: Hydromorphone
COLI_HUMAN

Docking Scores:
-8.26 -8.19 -6.99
Similarity Score:
N/A
Best Match:
N/A

L: Ibuprofen
COLI_HUMAN

Docking Scores:
-7.62 -7.61 -6.34
Similarity Score:
N/A
Best Match:
N/A

L: Codeine
COLI_HUMAN

Docking Scores:
-8.90 -7.76 -6.40
Similarity Score:
N/A
Best Match:
N/A

L: Dihydrocodeine
COMT_HUMAN

Docking Scores:
-6.07 -5.91 -6.72
Similarity Score:
25.59%
Best Match:
CHEMBL3425740

L: Acetylsalicylic acid
COMT_HUMAN

Docking Scores:
-5.38 -5.25 -5.76
Similarity Score:
25.62%
Best Match:
CHEMBL3980370

L: Hydromorphone
COMT_HUMAN

Docking Scores:
-6.29 -6.61 -6.24
Similarity Score:
27.23%
Best Match:
CHEMBL3425740

L: Ibuprofen
COMT_HUMAN

Docking Scores:
-5.73 -5.76 -6.03
Similarity Score:
23.16%
Best Match:
CHEMBL1324

L: Codeine
COMT_HUMAN

Docking Scores:
-6.36 -6.30 -6.38
Similarity Score:
22.62%
Best Match:
CHEMBL3819488

L: Dihydrocodeine
CRP_HUMAN

Docking Scores:
-6.05 -6.27
Similarity Score:
N/A
Best Match:
N/A

L: Acetylsalicylic acid
CRP_HUMAN

Docking Scores:
-4.90 -5.22
Similarity Score:
N/A
Best Match:
N/A

L: Hydromorphone
CRP_HUMAN

Docking Scores:
-6.56 -6.35
Similarity Score:
N/A
Best Match:
N/A

L: Ibuprofen
CRP_HUMAN

Docking Scores:
-5.53 -5.09
Similarity Score:
N/A
Best Match:
N/A

L: Codeine
CRP_HUMAN

Docking Scores:
-6.25 -6.41
Similarity Score:
N/A
Best Match:
N/A