NB001 #212 Output Download CSV

 
  The docking scores are in the AutoDock Vina metric.

CASP1_HUMAN

Docking Scores:
-4.39 -5.65 -5.31
Similarity Score:
47.93%
Best Match:
CHEMBL1221646

CDK5_HUMAN

Docking Scores:
-6.40 -6.77 -6.64
Similarity Score:
48.18%
Best Match:
CHEMBL3085251

CHLE_HUMAN

Docking Scores:
-6.83 -6.51 -6.71
Similarity Score:
33.87%
Best Match:
CHEMBL40302

CNR1_HUMAN

Docking Scores:
-6.17 -6.85 -7.03
Similarity Score:
40.23%
Best Match:
CHEMBL562668

CNR2_HUMAN

Docking Scores:
-6.75 -6.34
Similarity Score:
47.27%
Best Match:
CHEMBL2057805

COLI_HUMAN

Docking Scores:
-6.30 -6.43 -5.47
Similarity Score:
N/A
Best Match:
N/A

COMT_HUMAN

Docking Scores:
-5.14 -5.03 -5.28
Similarity Score:
23.29%
Best Match:
CHEMBL3954860

CRP_HUMAN

Docking Scores:
-5.17 -5.35
Similarity Score:
N/A
Best Match:
N/A

CXCR1_HUMAN

Docking Scores:
-7.00
Similarity Score:
19.33%
Best Match:
CHEMBL3609011

CXCR4_HUMAN

Docking Scores:
-5.71 -6.05 -5.40
Similarity Score:
38.10%
Best Match:
CHEMBL853

DRD2_HUMAN

Docking Scores:
-6.02
Similarity Score:
43.48%
Best Match:
CHEMBL3423329

DRD3_HUMAN

Docking Scores:
-6.18
Similarity Score:
40.00%
Best Match:
CHEMBL219916

DRD4_HUMAN

Docking Scores:
-6.51 -6.48
Similarity Score:
41.73%
Best Match:
CHEMBL51

EDN1_HUMAN

Docking Scores:
-6.10
Similarity Score:
N/A
Best Match:
N/A

ESR1_HUMAN

Docking Scores:
-6.60 -6.20 -6.29
Similarity Score:
33.79%
Best Match:
CHEMBL1318094

FABP5_HUMAN

Docking Scores:
-5.64 -4.50 -4.80
Similarity Score:
23.39%
Best Match:
CHEMBL3941588

FYN_HUMAN

Docking Scores:
-6.41
Similarity Score:
44.81%
Best Match:
CHEMBL3823849

GLRA3_HUMAN

Docking Scores:
-6.33 -6.67 -6.28
Similarity Score:
15.53%
Best Match:
CHEMBL4074873

GLRA3_HUMAN

Docking Scores:
-6.81
Similarity Score:
15.53%
Best Match:
CHEMBL4074873

GRM5_HUMAN

Docking Scores:
-7.32 -7.42 -7.07
Similarity Score:
33.59%
Best Match:
CHEMBL3914940