trial #459 Output Download CSV

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

Docking Scores:
-5.08 -4.96 -4.71
Similarity Score:
36.36%
Best Match:
CHEMBL1221503

CDK5_HUMAN

Docking Scores:
-6.05 -6.19 -7.02
Similarity Score:
38.83%
Best Match:
CHEMBL1976240

CHLE_HUMAN

Docking Scores:
-6.01 -5.90 -6.11
Similarity Score:
52.38%
Best Match:
CHEMBL521589

CNR1_HUMAN

Docking Scores:
-4.81 -6.20 -6.33
Similarity Score:
48.75%
Best Match:
CHEMBL478210

CNR2_HUMAN

Docking Scores:
-5.76 -5.77
Similarity Score:
48.75%
Best Match:
CHEMBL478210

COLI_HUMAN

Docking Scores:
-5.92 -5.72 -5.21
Similarity Score:
N/A
Best Match:
N/A

COMT_HUMAN

Docking Scores:
-4.40 -4.30 -4.66
Similarity Score:
31.09%
Best Match:
CHEMBL4639358

CRP_HUMAN

Docking Scores:
-4.41 -4.19
Similarity Score:
N/A
Best Match:
N/A

CXCR1_HUMAN

Docking Scores:
-6.17
Similarity Score:
30.10%
Best Match:
CHEMBL4442431

CXCR4_HUMAN

Docking Scores:
-6.11 -5.18 -5.74
Similarity Score:
38.55%
Best Match:
CHEMBL4440964

DRD2_HUMAN

Docking Scores:
-5.69
Similarity Score:
72.00%
Best Match:
CHEMBL59

DRD3_HUMAN

Docking Scores:
-6.26
Similarity Score:
72.00%
Best Match:
CHEMBL59

DRD4_HUMAN

Docking Scores:
-6.01 -6.31
Similarity Score:
72.00%
Best Match:
CHEMBL59

EDN1_HUMAN

Docking Scores:
-5.89
Similarity Score:
N/A
Best Match:
N/A

ESR1_HUMAN

Docking Scores:
-5.77 -5.75 -5.73
Similarity Score:
50.77%
Best Match:
CHEMBL311636

FABP5_HUMAN

Docking Scores:
-5.08 -3.99 -4.14
Similarity Score:
37.37%
Best Match:
CHEMBL212860

FYN_HUMAN

Docking Scores:
-5.85
Similarity Score:
36.26%
Best Match:
CHEMBL221753

GLRA3_HUMAN

Docking Scores:
-5.62 -5.67 -5.71
Similarity Score:
20.00%
Best Match:
CHEMBL4070615

GLRA3_HUMAN

Docking Scores:
-6.13
Similarity Score:
20.00%
Best Match:
CHEMBL4070615

GRM5_HUMAN

Docking Scores:
-5.84 -5.92 -5.89
Similarity Score:
39.77%
Best Match:
CHEMBL1289626