CHEMBL98

GPTKB entity

Statements (55)
Predicate Object
gptkbp:instanceOf gptkb:chemical_compound
gptkbp:ATCCode gptkb:N02BA01
B01AC06
gptkbp:bioavailability 80-100%
gptkbp:CASNumber 50-78-2
gptkbp:contains gptkb:WHO_Model_List_of_Essential_Medicines
gptkbp:contraindication peptic ulcer
children with viral infections
hypersensitivity to NSAIDs
gptkbp:eliminationHalfLife 2-3 hours
gptkbp:hasFirstSynthesisBy gptkb:Felix_Hoffmann
gptkbp:hasFirstSynthesisYear 1897
gptkbp:hasInChIKey BSYNRYMUTXBXSQ-UHFFFAOYSA-N
gptkbp:hasLogP 1.19
gptkbp:hasMolecularFormula C9H8O4
gptkbp:hasPatent US644814A
gptkbp:hasPharmacologyAction analgesic
anti-inflammatory
antipyretic
antiplatelet
gptkbp:hasSMILES CC(=O)Oc1ccccc1C(=O)O
gptkbp:hasUNII R16CO5Y76E
gptkbp:hasWikipediaPage gptkb:Aspirin
https://www.w3.org/2000/01/rdf-schema#label CHEMBL98
gptkbp:indication fever
pain
inflammation
prevention of cardiovascular events
gptkbp:isApprovedDrug true
gptkbp:legalStatus gptkb:OTC
gptkbp:marketedAs gptkb:Bayer
gptkbp:mechanismOfAction irreversible inhibition of cyclooxygenase (COX-1 and COX-2)
gptkbp:meltingPoint 135°C
gptkbp:metabolism hepatic
gptkbp:molecularWeight 180.16
gptkbp:name gptkb:Aspirin
gptkbp:PubChem_CID gptkb:CHEMBL98
2157
2244
D00109
DB00945
CHEBI:15365
gptkbp:routeOfAdministration oral
intravenous
rectal
gptkbp:sideEffect gptkb:Reye's_syndrome
gastrointestinal bleeding
allergic reaction
gptkbp:synonym gptkb:2-Acetoxybenzoic_acid
gptkb:ASA
gptkb:Acetylsalicylic_acid
gptkbp:target gptkb:PTGS2
gptkb:PTGS1
gptkbp:bfsParent gptkb:lysergic_acid_diethylamide
gptkbp:bfsLayer 6