Target name

P16116: Aldose reductase


  Protein function

Catalyzes the NADPH-dependent reduction of a wide variety of carbonyl-containing compounds to their corresponding alcohols with a broad range of catalytic efficiencies.

  Database links

Uniprot primary ID P16116
PDB ID 2GO6
DrugBank ID
BioGrid ID
GuidetoPHARMACOLOGY ID
PharmGKB ID
KEGG ID
DIP ID
STRING ID 9913.ENSBTAP00000013082
IntAct ID
DMDM
BRENDA
Reactome
SignaLink
BioCyc
Entrez Gene (Gene ID)
BindingDB P16116

  Model Performance Metrics

Fingerprint type Sensitivity SEN_std Specificity SPE_std Accuracy ACC_std F1-score F1-score_std AUC AUC_std MCC MCC_std Download model
FP2 fingerprints 0.786 0.014 0.964 0.004 0.875 0.005 0.863 0.008 0.960 0.000 0.763 0.008 Download
Estate fingerprints 0.837 0.013 0.845 0.007 0.841 0.007 0.836 0.007 0.939 0.003 0.682 0.009 Download
MACCS fingerprints 0.926 0.008 0.916 0.005 0.921 0.003 0.917 0.007 0.980 0.000 0.840 0.011 Download
Daylight fingerprints 0.663 0.012 1.000 0.007 0.836 0.007 0.797 0.009 0.940 0.005 0.709 0.011 Download
ECFP2 fingerprints 0.966 0.005 0.972 0.000 0.969 0.003 0.966 0.005 0.990 0.000 0.935 0.007 Download
ECFP4 fingerprints 0.980 0.000 0.972 0.005 0.976 0.005 0.976 0.005 0.990 0.000 0.950 0.000 Download
ECFP6 fingerprints 0.945 0.007 0.977 0.006 0.961 0.007 0.958 0.004 0.990 0.000 0.921 0.007 Download

  Download datasets

Positive dataset Negative dataset


Copyright @ 2012-2014 Computational Biology & Drug Design Group,
School of Pharmaceutical Sciences, Central South University. All rights reserved.

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