TargetNet


P00374

Dihydrofolate reductase


Function

Key enzyme in folate metabolism. Contributes to the de novo mitochondrial thymidylate biosynthesis pathway. Catalyzes an essential reaction for de novo glycine and purine synthesis, and for DNA precursor synthesis. Binds its own mRNA and that of DHFRL1.


Database Links

Database Links
UniProt P00374
PDB 1BOZ, 1DHF, 1DLR, 1DLS, 1DRF, 1HFP, 1HFQ, 1HFR, 1KMS, 1KMV, 1MVS, 1MVT, 1OHJ, 1OHK, 1PD8, 1PD9, 1PDB, 1S3U, 1S3V, 1S3W, 1U71, 1U72, 1YHO, 2C2S, 2C2T, 2DHF, 2W3A, 2W3B, 2W3M, 3EIG, 3F8Y, 3F8Z, 3F91, 3FS6, 3GHC, 3GHV, 3GHW, 3GI2, 3GYF, 3L3R, 3N0H, 3NTZ, 3NU0, 3NXO, 3NXR, 3NXT, 3NXV, 3NXX, 3NXY, 3NZD, 3OAF, 3S3V, 3S7A, 4DDR, 4G95, 4KAK, 4KBN, 4KD7, 4KEB, 4KFJ, 4M6J, 4M6K, 4M6L
BioGrid 108065
BindingDB P00374
DrugBank DB00250, DB01093, DB00555, DB00563, DB00157, DB00642, DB01131, DB00205, DB00440, DB01157
Guide to PHARMACOLOGY 2603
PharmGKB PA143
KEGG hsa:1719
BioCyc Not available
Entrez Gene (GeneID) 1719

Chemical Space of the Positive Compounds


Model Performance Metrics

Metric Mean Value Standard Deviation
AUC 0.9555 0.0022
Accuracy 0.9036 0.0036
Sensitivity 0.8968 0.0069
Specificity 0.9095 0.0038
BEDROC 0.9842 0.005
MCC Threshold 0.502 N/A
MCC 0.8164 N/A
F-score Threshold 0.502 N/A
F-score 0.9014 N/A

Downloads

R Model Object

Random Forest model object (.RData)

Download RData

Positive Set

SMILES string + affinity value (.tsv)

Download TSV


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Page generated on: 2014-04-29 14:39:16