Target name

P13922: Bifunctional dihydrofolate reductase-thymidylate synthase


  Protein function

Bifunctional enzyme. Involved in de novo dTMP biosynthesis. Key enzyme in folate metabolism. Catalyzes an essential reaction for de novo glycine and purine synthesis, DNA precursor synthesis, and for the conversion of dUMP to dTMP.

  Database links

Uniprot primary ID P13922
PDB ID 1J3K 3DG8 3DGA 1J3J 1J3I
DrugBank ID DB00205 DB01131 DB01299
BioGrid ID
GuidetoPHARMACOLOGY ID
PharmGKB ID
KEGG ID
DIP ID
STRING ID
IntAct ID
DMDM
BRENDA 1.5.1.3 2.1.1.45
Reactome
SignaLink
BioCyc
Entrez Gene (Gene ID)
BindingDB

  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 0.940 0.000 1.000 0.004 0.970 0.000 0.970 0.000 0.990 0.000 0.938 0.004 Download
Estate fingerprints 0.960 0.000 0.980 0.005 0.970 0.000 0.970 0.000 0.990 0.000 0.937 0.005 Download
MACCS fingerprints 0.968 0.004 0.992 0.000 0.980 0.000 0.980 0.000 0.990 0.000 0.958 0.004 Download
Daylight fingerprints 0.940 0.000 0.820 0.000 0.880 0.000 0.890 0.000 0.890 0.000 0.770 0.000 Download
ECFP2 fingerprints 0.970 0.000 0.990 0.005 0.980 0.000 0.980 0.000 0.990 0.000 0.953 0.005 Download
ECFP4 fingerprints 0.969 0.003 0.991 0.000 0.980 0.000 0.980 0.000 0.990 0.000 0.959 0.003 Download
ECFP6 fingerprints 0.955 0.005 0.985 0.008 0.970 0.000 0.970 0.000 0.990 0.000 0.935 0.005 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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 E-mail: biomed@csu.edu.cn