Molecule Details
InChIKeyOEKWJQXRCDYSHL-FNOIDJSQSA-N
Canonical SMILESCCCSc1nc(N[C@@H]2C[C@H]2c2ccc(F)c(F)c2)c2nnn([C@@H]3C[C@H](OCCO)[C@@H](O)[C@H]3O)c2n1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Cross-Family
Avg pChEMBL7.07
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB08816
Drug NameTicagrelor
CAS Number274693-27-5
Groups approved investigational
ATC Codes B01AC24
DescriptionTicagrelor, or AZD6140, was first described in the literature in 2003.[A204170,A2903] Ticagrelor is an ADP derivative developed for its P2Y<sub>12</sub> receptor antagonism.[A2903] Unlike [clopidogrel], ticagrelor is not a prodrug.[A2903] It is marketed by Astra Zeneca as Brilinta in the US[L14201] ...

Categories: Anticoagulants Antiplatelet agents Blood and Blood Forming Organs Carbohydrates Cytochrome P-450 CYP2B6 Inducers Cytochrome P-450 CYP2B6 Inducers (weak) Cytochrome P-450 CYP2C9 Inducers Cytochrome P-450 CYP2C9 Inducers (strength unknown) Cytochrome P-450 CYP2C9 Inducers (weak) Cytochrome P-450 CYP2C9 Inhibitors Cytochrome P-450 CYP2C9 Inhibitors (weak) Cytochrome P-450 CYP3A Inhibitors Cytochrome P-450 CYP3A Substrates Cytochrome P-450 CYP3A4 Inhibitors Cytochrome P-450 CYP3A4 Inhibitors (strength unknown) Cytochrome P-450 CYP3A4 Inhibitors (weak) Cytochrome P-450 CYP3A4 Substrates Cytochrome P-450 CYP3A5 Inhibitors Cytochrome P-450 CYP3A5 Substrates Cytochrome P-450 Enzyme Inducers Cytochrome P-450 Enzyme Inhibitors Cytochrome P-450 Substrates Decreased Platelet Aggregation Glycosides Hematologic Agents Heterocyclic Compounds, Fused-Ring Nucleic Acids, Nucleotides, and Nucleosides Nucleosides P-glycoprotein inhibitors P-glycoprotein substrates P2Y12 Platelet Inhibitor Phenylalanine Hydroxylase Activators Platelet Aggregation Inhibitors Excl. Heparin Purine Nucleosides Purinergic Agents Purinergic Antagonists Purinergic P2 Receptor Antagonists Purinergic P2Y Receptor Antagonists Purines Ribonucleosides
Cross-references: BindingDB: 50397205 ChEBI: 68558 CHEMBL398435 ChemSpider: 8047109 Drugs Product Database (DPD): 20742 D09017 PDB: TIQ PharmGKB: PA165374673 PubChem:9871419 PubChem:175427101 RxCUI: 1116632 Wikipedia: Ticagrelor ZINC: ZINC000028957444
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
Q9H244 P2RY12 Homo sapiens Human PF00001 7.8 IC50 ChEMBL;BindingDB
Q01959 SLC6A3 Homo sapiens Human PF00209 6.3 Ki ChEMBL
DrugBank Target Actions (11)
Target Gene Target Name Action Type
P02768 ALB Albumin binder carriers
P20815 CYP3A5 Cytochrome P450 3A5 activator enzymes
P11712 CYP2C9 Cytochrome P450 2C9 inducer enzymes
P20813 CYP2B6 Cytochrome P450 2B6 inducer enzymes
P08684 CYP3A4 Cytochrome P450 3A4 inhibitor enzymes
P11712 CYP2C9 Cytochrome P450 2C9 inhibitor enzymes
P08684 CYP3A4 Cytochrome P450 3A4 substrate enzymes
P20815 CYP3A5 Cytochrome P450 3A5 substrate enzymes
Q9H244 P2RY12 P2Y purinoceptor 12 inhibitor targets
P08183 ABCB1 ATP-dependent translocase ABCB1 inhibitor transporters
P08183 ABCB1 ATP-dependent translocase ABCB1 substrate transporters