The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016

Id	http://purl.obolibrary.org/obo/CHEBI_66876 http://purl.obolibrary.org/obo/CHEBI_66876
Preferred Name	avanafil
Synonyms	4-{[(3-chloro-4-methoxyphenyl)methyl]amino}-2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-N-(pyrimidin-2-ylmethyl)pyrimidine-5-carboxamide 4-[(3-chloro-4-methoxybenzyl)amino]-2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-N-(pyrimidin-2-ylmethyl)pyrimidine-5-carboxamide Stendra (S)-4-(3-Chloro-4-methoxybenzylamino)-2-(2-hydroxymethylpyrrolidin-1-yl)-N-pyrimidin-2-ylmethyl-5-pyrimidinecarboxamide avanafil C23H26ClN7O3
Type	http://www.w3.org/2002/07/owl#Class

prefLabel	avanafil
label	avanafil
DBSynonym	ta-1790
Definition	Avanafil is a new phosphodiesterase-5 inhibitor that is faster acting and more selective than other drugs belonging to the same class. Chemically, it is a derivative of pyrimidine and is only available as the S-enantiomer. FDA approved on April 27, 2012. A carboxamide obtained by formal condensation of the carboxy group of 4-[(3-chloro-4-methoxybenzyl)amino]-2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]pyrimidine-5-carboxylic acid with the amino group of pyrimidin-2-ylmethylamine. Used for treatment of erectile dysfunction.
has pharmacological target	http://purl.obolibrary.org/obo/dinto_1637
inhibits	http://purl.obolibrary.org/obo/dinto_1637
type	http://www.w3.org/2002/07/owl#Class
has role	http://purl.obolibrary.org/obo/CHEBI_35620 http://purl.obolibrary.org/obo/CHEBI_50218
InChIKey	InChIKey=WEAJZXNPAWBCOA-INIZCTEOSA-N
is metabolised by	http://purl.obolibrary.org/obo/dinto_0901
AHFScode	24:12.12
Synonym	4-{[(3-chloro-4-methoxyphenyl)methyl]amino}-2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-N-(pyrimidin-2-ylmethyl)pyrimidine-5-carboxamide 4-[(3-chloro-4-methoxybenzyl)amino]-2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-N-(pyrimidin-2-ylmethyl)pyrimidine-5-carboxamide Stendra (S)-4-(3-Chloro-4-methoxybenzylamino)-2-(2-hydroxymethylpyrrolidin-1-yl)-N-pyrimidin-2-ylmethyl-5-pyrimidinecarboxamide avanafil C23H26ClN7O3 See more See less
xref	Wikipedia:Avanafil CiteXplore:22704456 CiteXplore:20939743 CiteXplore:18197727 Drugs.com:http://www.drugs.com/mtm/avanafil.html CiteXplore:22248153 CiteXplore:18491987 Patent:US6403597 KEGG DRUG:D03217 CiteXplore:22448738 CiteXplore:22759639 National Drug Code Directory:62541-303-30 ChEMBL:1385392 Patent:EP1366760 CASRN:330784-47-9 CiteXplore:21745238 CiteXplore:22788525 CiteXplore:22384456 ChEBI:66876 RxList:http://www.rxlist.com/stendra-drug.htm CiteXplore:22087063 Reaxys:11746013 CiteXplore:21905762 CiteXplore:20637970 Wikipedia:http://en.wikipedia.org/wiki/Avanafil See more See less
CASRN	330784-47-9
prefixIRI	obo2:CHEBI_66876
SMILES	COc1ccc(CNc2nc(ncc2C(=O)NCc2ncccn2)N2CCC[C@H]2CO)cc1Cl COC1=C(Cl)C=C(CNC2=C(C=NC(=N2)N2CCC[C@H]2CO)C(=O)NCC2=NC=CC=N2)C=C1
may interact with	http://purl.obolibrary.org/obo/CHEBI_28787 http://purl.obolibrary.org/obo/CHEBI_10033 http://purl.obolibrary.org/obo/CHEBI_50122 http://purl.obolibrary.org/obo/dinto_DB00199 http://purl.obolibrary.org/obo/CHEBI_7772 http://purl.obolibrary.org/obo/dinto_DB00503 http://purl.obolibrary.org/obo/CHEBI_6062 http://purl.obolibrary.org/obo/CHEBI_6061 http://purl.obolibrary.org/obo/CHEBI_68845 http://purl.obolibrary.org/obo/dinto_DB01026 http://purl.obolibrary.org/obo/CHEBI_47781 See more See less
InChI	InChI=1S/C23H26ClN7O3/c1-34-19-6-5-15(10-18(19)24)11-27-21-17(22(33)28-13-20-25-7-3-8-26-20)12-29-23(30-21)31-9-2-4-16(31)14-32/h3,5-8,10,12,16,32H,2,4,9,11,13-14H2,1H3,(H,28,33)(H,27,29,30)/t16-/m0/s1
DBBrand	stendra
subClassOf	http://purl.obolibrary.org/obo/dinto_000055

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