lvkui #290 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

CASP1_HUMAN

Docking Scores:
-6.85 -8.11 -6.91
Similarity Score:
31.36%
Best Match:
CHEMBL115336

CDK5_HUMAN

Docking Scores:
-8.88 -9.07 -9.83
Similarity Score:
37.31%
Best Match:
CHEMBL1989471

CHLE_HUMAN

Docking Scores:
-9.02 -9.19 -9.07
Similarity Score:
42.44%
Best Match:
CHEMBL1819174

CNR1_HUMAN

Docking Scores:
-8.60 -9.32 -10.22
Similarity Score:
43.90%
Best Match:
CHEMBL1091466

CNR2_HUMAN

Docking Scores:
-9.81 -9.16
Similarity Score:
43.81%
Best Match:
CHEMBL1089351

COLI_HUMAN

Docking Scores:
-8.73 -8.90 -9.00
Similarity Score:
N/A
Best Match:
N/A

COMT_HUMAN

Docking Scores:
-6.79 -6.19 -6.51
Similarity Score:
30.77%
Best Match:
CHEMBL3799913

CRP_HUMAN

Docking Scores:
-6.77 -6.88
Similarity Score:
N/A
Best Match:
N/A

CXCR1_HUMAN

Docking Scores:
-6.04
Similarity Score:
30.88%
Best Match:
CHEMBL3609016

CXCR4_HUMAN

Docking Scores:
-8.98 -7.53 -8.87
Similarity Score:
29.86%
Best Match:
CHEMBL568245

DRD2_HUMAN

Docking Scores:
-9.43
Similarity Score:
36.96%
Best Match:
CHEMBL3676914

DRD3_HUMAN

Docking Scores:
-8.56
Similarity Score:
36.96%
Best Match:
CHEMBL3676914

DRD4_HUMAN

Docking Scores:
-9.22 -9.60
Similarity Score:
34.78%
Best Match:
CHEMBL3818940

EDN1_HUMAN

Docking Scores:
-7.89
Similarity Score:
N/A
Best Match:
N/A

ESR1_HUMAN

Docking Scores:
-8.07 -8.90 -8.92
Similarity Score:
35.44%
Best Match:
CHEMBL187314

FABP5_HUMAN

Docking Scores:
-8.22 -6.68 -6.38
Similarity Score:
39.01%
Best Match:
CHEMBL3941588

FYN_HUMAN

Docking Scores:
-9.40
Similarity Score:
38.95%
Best Match:
CHEMBL1990884

GLRA3_HUMAN

Docking Scores:
-8.71 -8.63 -8.55
Similarity Score:
27.16%
Best Match:
CHEMBL4074873

GLRA3_HUMAN

Docking Scores:
-9.94
Similarity Score:
27.16%
Best Match:
CHEMBL4074873

GRM5_HUMAN

Docking Scores:
-8.88 -6.69 -6.58
Similarity Score:
41.90%
Best Match:
CHEMBL439571