Molecule Details
InChIKeyQQHMKNYGKVVGCZ-UHFFFAOYSA-N
Canonical SMILESN=C1CCCN1Cc1[nH]c(=O)[nH]c(=O)c1Cl
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Homologous
Avg pChEMBL7.62
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB09343
Drug NameTipiracil
CAS Number183204-74-2
Groups approved investigational
ATC Codes nan
DescriptionTipiracil is a thymidine phosphorylase inhibitor. It is used in combination with trifluridine, in a ratio of 1:0.5, to form TAS-102. The main function of Tipiracil in TAS-102 is to increase trifluridine bioavailability by inhibiting its catabolism.[A31255] TAS-102 is indicated for the treatment of m...

Categories: MATE 1 Substrates MATE 1 Substrates with a Narrow Therapeutic Index MATE substrates Narrow Therapeutic Index Drugs OCT2 Substrates OCT2 Substrates with a Narrow Therapeutic Index Pyrimidines Pyrimidinones Thymidine Phosphorylase Inhibitor
Cross-references: BindingDB: 50531739 ChEBI: 90879 CHEMBL235668 ChemSpider: 13243748 Drugs Product Database (DPD): 22929 PubChem:6323266 PubChem:310265218 RxCUI: 1670304 Wikipedia: Tipiracil ZINC: ZINC000100032379
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
P19971 TYMP Homo sapiens Human PF02885 PF00591 PF07831 7.7 IC50 ChEMBL;BindingDB
P07650 deoA Escherichia coli (strain K12) Pathogen PF02885 PF00591 PF07831 7.6 IC50 ChEMBL
DrugBank Target Actions (3)
Target Gene Target Name Action Type
P19971 TYMP Thymidine phosphorylase inhibitor targets
O15244 SLC22A2 Solute carrier family 22 member 2 substrate transporters
Q96FL8 SLC47A1 Multidrug and toxin extrusion protein 1 substrate transporters