LTJ #73 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Dihydrocodeine
CASP1_HUMAN

Docking Scores:
-6.49 -7.42 -6.33
Similarity Score:
41.33%
Best Match:
CHEMBL3898379

L: Acetylsalicylic acid
CASP1_HUMAN

Docking Scores:
-4.81 -5.70 -4.75
Similarity Score:
39.20%
Best Match:
CHEMBL101145

L: Hydromorphone
CASP1_HUMAN

Docking Scores:
-6.40 -7.46 -6.46
Similarity Score:
46.15%
Best Match:
CHEMBL2371932

L: Ibuprofen
CASP1_HUMAN

Docking Scores:
-5.84 -6.94 -5.64
Similarity Score:
38.46%
Best Match:
CHEMBL466565

L: Codeine
CASP1_HUMAN

Docking Scores:
-5.80 -7.68 -6.21
Similarity Score:
34.47%
Best Match:
CHEMBL3898379

L: Dihydrocodeine
CDK5_HUMAN

Docking Scores:
-7.54 -8.01 -6.70
Similarity Score:
33.02%
Best Match:
CHEMBL422897

L: Acetylsalicylic acid
CDK5_HUMAN

Docking Scores:
-6.17 -6.63 -6.92
Similarity Score:
36.19%
Best Match:
CHEMBL2007296

L: Hydromorphone
CDK5_HUMAN

Docking Scores:
-7.59 -7.51 -5.44
Similarity Score:
32.11%
Best Match:
CHEMBL422897

L: Ibuprofen
CDK5_HUMAN

Docking Scores:
-7.10 -7.44 -8.10
Similarity Score:
30.23%
Best Match:
CHEMBL1974288

L: Codeine
CDK5_HUMAN

Docking Scores:
-6.41 -7.34 -5.71
Similarity Score:
29.44%
Best Match:
CHEMBL422897

L: Dihydrocodeine
CHLE_HUMAN

Docking Scores:
-8.77 -8.69 -8.99
Similarity Score:
46.24%
Best Match:
CHEMBL189906

L: Acetylsalicylic acid
CHLE_HUMAN

Docking Scores:
-6.69 -6.27 -6.40
Similarity Score:
36.79%
Best Match:
CHEMBL544592

L: Hydromorphone
CHLE_HUMAN

Docking Scores:
-9.46 -9.35 -9.79
Similarity Score:
45.37%
Best Match:
CHEMBL3410956

L: Ibuprofen
CHLE_HUMAN

Docking Scores:
-7.66 -7.36 -7.33
Similarity Score:
41.54%
Best Match:
CHEMBL51931

L: Codeine
CHLE_HUMAN

Docking Scores:
-9.14 -8.82 -8.92
Similarity Score:
43.54%
Best Match:
CHEMBL4085222

L: Dihydrocodeine
CNR1_HUMAN

Docking Scores:
-7.64 -8.72 -8.99
Similarity Score:
54.48%
Best Match:
CHEMBL228349

L: Acetylsalicylic acid
CNR1_HUMAN

Docking Scores:
-5.65 -6.37 -6.45
Similarity Score:
47.83%
Best Match:
CHEMBL243334

L: Hydromorphone
CNR1_HUMAN

Docking Scores:
-8.78 -8.50 -9.02
Similarity Score:
58.62%
Best Match:
CHEMBL228349

L: Ibuprofen
CNR1_HUMAN

Docking Scores:
-7.43 -7.51 -7.98
Similarity Score:
51.61%
Best Match:
CHEMBL391380

L: Codeine
CNR1_HUMAN

Docking Scores:
-8.22 -8.45 -9.29
Similarity Score:
57.39%
Best Match:
CHEMBL303479