TargetNet


O00748

Cocaine esterase


Function

Involved in the detoxification of xenobiotics and in the activation of ester and amide prodrugs. Shows high catalytic efficiency for hydrolysis of cocaine, 4-methylumbelliferyl acetate, heroin and 6-monoacetylmorphine.


Database Links

Database Links
UniProt O00748
PDB Not available
BioGrid Not available
BindingDB O00748
DrugBank Not available
Guide to PHARMACOLOGY Not available
PharmGKB PA377
KEGG hsa:8824
BioCyc Not available
Entrez Gene (GeneID) 8824

Chemical Space of the Positive Compounds


Model Performance Metrics

Metric Mean Value Standard Deviation
AUC 0.9253 0.0095
Accuracy 0.86 0.0109
Sensitivity 0.8677 0.0177
Specificity 0.8531 0.0117
BEDROC 0.9814 0.0094
MCC Threshold 0.588 N/A
MCC 0.7383 N/A
F-score Threshold 0.384 N/A
F-score 0.8664 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 14:39:14