EMBL-EBI | Chemical Biology Resources | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:72296 - apixaban

Default Structure
ChEBI IDCHEBI:72296
ChEBI Nameapixaban
Stars
DefinitionA pyrazolopyridine that is 7-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxamide substituted at position 1 by a 4-methoxyphenyl group and at position 6 by a 4-(2-oxopiperidin-1-yl)phenyl group. It is used for the prevention and treatment of thromboembolic diseases.
Last Modified7 March 2013
SubmitterSteve
DownloadsMolfile
FormulaC25H25N5O4
Net Charge0
Average Mass459.506
Monoisotopic Mass459.19065
SMILESCOc1ccc(-n2nc(C(N)=O)c3c2C(=O)N(c2ccc(N4CCCCC4=O)cc2)CC3)cc1
InChIInChI=1S/C25H25N5O4/c1-34-19-11-9-18(10-12-19)30-23-20(22(27-30)24(26)32)13-15-29(25(23)33)17-7-5-16(6-8-17)28-14-3-2-4-21(28)31/h5-12H,2-4,13-15H2,1H3,(H2,26,32)
InChIKeyQNZCBYKSOIHPEH-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Roles:
antiviral agent  A substance that destroys or inhibits replication of viruses.
EC 3.4.21.6 (coagulation factor Xa) inhibitor  An EC 3.4.21.* (serine endopeptidase) inhibitor that interferes with the action of coagulation factor Xa (EC 3.4.21.6).
Applications:
anti-arrhythmia drug  A drug used for the treatment or prevention of cardiac arrhythmias. Anti-arrhythmia drugs may affect the polarisation-repolarisation phase of the action potential, its excitability or refractoriness, or impulse conduction or membrane responsiveness within cardiac fibres.
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
cardiovascular drug  A drug that affects the rate or intensity of cardiac contraction, blood vessel diameter or blood volume.
anti-anaemic agent  A compound which increases either the number of red cells or the amount of haemoglobin in the blood.
anticoagulant  An agent that prevents blood clotting.
hepatoprotective agent  Any compound that is able to prevent damage to the liver.
ChEBI Ontology
Outgoing Relation(s)
apixaban (CHEBI:72296) has role anti-anaemic agent (CHEBI:75835)
apixaban (CHEBI:72296) has role anti-arrhythmia drug (CHEBI:38070)
apixaban (CHEBI:72296) has role anticoagulant (CHEBI:50249)
apixaban (CHEBI:72296) has role antineoplastic agent (CHEBI:35610)
apixaban (CHEBI:72296) has role antiviral agent (CHEBI:22587)
apixaban (CHEBI:72296) has role cardiovascular drug (CHEBI:35554)
apixaban (CHEBI:72296) has role EC 3.4.21.6 (coagulation factor Xa) inhibitor (CHEBI:68581)
apixaban (CHEBI:72296) has role hepatoprotective agent (CHEBI:62868)
apixaban (CHEBI:72296) is a aromatic ether (CHEBI:35618)
apixaban (CHEBI:72296) is a lactam (CHEBI:24995)
apixaban (CHEBI:72296) is a piperidones (CHEBI:48589)
apixaban (CHEBI:72296) is a pyrazolopyridine (CHEBI:46699)
IUPAC Name 
1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxamide
INNs  Source
apixabanKEGG DRUG
apixabanWHO MedNet
apixabánWHO MedNet
apixabanumWHO MedNet
Synonyms  Source
BMS-562247DrugBank
BMS 562247-01ChemIDplus
BMS-562247-01ChemIDplus
Brand Names  Source
Apixaban accordChEMBL
EliquisKEGG DRUG
Manual XrefsDatabases
ApixabanWikipedia
D03213KEGG DRUG
DB06605DrugBank
GG2PDBeChem
US2007259913Patent
WO2007022165Patent
WO2008031782Patent
WO2010030983Patent
Registry NumbersSources
Reaxys:11244786Reaxys
CAS:503612-47-3KEGG DRUG
CAS:503612-47-3ChemIDplus
Citations