CHEMBL39

GPTKB entity

Statements (54)
Predicate Object
gptkbp:instanceOf gptkb:chemical_compound
gptkbp:approvalYear 1899
gptkbp:ATCCode gptkb:N02BA01
B01AC06
gptkbp:bioavailability 80-100%
gptkbp:CASNumber 50-78-2
gptkbp:contraindication asthma
peptic ulcer
children with viral infections
bleeding disorder
gptkbp:drugClass nonsteroidal anti-inflammatory drug
gptkbp:excretion urine
gptkbp:halfLife 2-3 hours
gptkbp:hasInChIKey BSYNRYMUTXBXSQ-UHFFFAOYSA-N
gptkbp:hasLogP 1.19
gptkbp:hasMolecularFormula C9H8O4
gptkbp:hasPharmacologyAction analgesic
anti-inflammatory
antipyretic
antiplatelet
gptkbp:haspKa 3.5
gptkbp:hasSMILES CC(=O)Oc1ccccc1C(=O)O
gptkbp:hasUNII R16CO5Y76E
gptkbp:hasWikipediaPage gptkb:Aspirin
https://www.w3.org/2000/01/rdf-schema#label CHEMBL39
gptkbp:indication fever
pain
inflammation
prevention of cardiovascular events
gptkbp:isApprovedDrug true
gptkbp:manufacturer gptkb:Bayer
gptkbp:meltingPoint 135°C
gptkbp:MeSH_ID D001241
gptkbp:metabolism liver
gptkbp:molecularWeight 180.16
gptkbp:name gptkb:Aspirin
gptkbp:originatedIn synthesized
gptkbp:PubChem_CID 2244
DB00945
15365
gptkbp:routeOfAdministration oral
intravenous
rectal
gptkbp:sideEffect gastrointestinal bleeding
allergic reaction
ulcer
gptkbp:synonym gptkb:2-Acetoxybenzoic_acid
gptkb:ASA
gptkb:Acetylsalicylic_acid
gptkbp:target gptkb:PTGS2
gptkb:PTGS1
gptkbp:bfsParent gptkb:Adrenaline
gptkb:Serotonin
gptkbp:bfsLayer 6