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The Drug-Drug Interactions Ontology
Last uploaded:
February 11, 2016
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| Id | http://purl.obolibrary.org/obo/CHEBI_71940
http://purl.obolibrary.org/obo/CHEBI_71940
|
|---|---|
| Preferred Name | tadalafil |
| Synonyms |
tadalafil
(2R,8R)-2-(2H-1,3-benzodioxol-5-yl)-6-methyl-3,6,17-triazatetracyclo[8.7.0.0^{3,8}.0^{11,16}]heptadeca-1(10),11,13,15-tetraene-4,7-dione
Cialis
(6R,12aR)-6-(1,3-benzodioxol-5-yl)-2-methyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Adcirca
6-BENZO[1,3]DIOXOL-5-YL-2-METHYL-2,3,6,7,12,12A-HEXAHYDRO-PYRAZINO[1',2':1,6]PYRIDO[3,4-B]INDOLE-1,4-DIONE
(6R-trans)-6-(1,3-Benzodioxol-5-yl)-2,3,6,7,12,12a-hexahydro-2-methyl-pyrazino(1',2':1,6)pyrido(3,4-b)indole-1,4-dione
C22H19N3O4
(6R,12aR)-2,3,6,7,12,12a-Hexahydro-2-methyl-6-(3,4-(methylenedioxy)phenyl) pyrazino(1',2':1,6)pyrido(3,4-b)indole-1,4-dione
|
| Type | http://www.w3.org/2002/07/owl#Class |
All Properties
| label |
tadalafil
|
|---|---|
| prefLabel |
tadalafil
|
| is metabolised by | |
| Definition |
A pyrazinopyridoindole that is 2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione substituted at position 2 by a methyl group and at position 6 by a 1,3-benzodioxol-5-yl group (the 6R,12aR-diastereomer). A phosphodiesterase V inhibitor inhibitor, currently marketed in pill form for treating erectile dysfunction under the name Cialis; and under the name Adcirca for the treatment of pulmonary arterial hypertension.
|
| DBBrand |
cialis
|
| ATCCode |
G04BE08
|
| SMILES |
[H][C@]12CC3=C(NC4=CC=CC=C34)[C@H](N1C(=O)CN(C)C2=O)C1=CC2=C(OCO2)C=C1
[H][C@]12Cc3c([nH]c4ccccc34)[C@H](N1C(=O)CN(C)C2=O)c1ccc2OCOc2c1
|
| InChI |
InChI=1S/C22H19N3O4/c1-24-10-19(26)25-16(22(24)27)9-14-13-4-2-3-5-15(13)23-20(14)21(25)12-6-7-17-18(8-12)29-11-28-17/h2-8,16,21,23H,9-11H2,1H3/t16-,21-/m1/s1
|
| CASRN |
171596-29-5
|
| prefixIRI |
obo2:CHEBI_71940
|
| altId |
CHEBI:32177
CHEBI:41488
|
| Synonym |
tadalafil
(2R,8R)-2-(2H-1,3-benzodioxol-5-yl)-6-methyl-3,6,17-triazatetracyclo[8.7.0.0^{3,8}.0^{11,16}]heptadeca-1(10),11,13,15-tetraene-4,7-dione
Cialis
(6R,12aR)-6-(1,3-benzodioxol-5-yl)-2-methyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Adcirca
6-BENZO[1,3]DIOXOL-5-YL-2-METHYL-2,3,6,7,12,12A-HEXAHYDRO-PYRAZINO[1',2':1,6]PYRIDO[3,4-B]INDOLE-1,4-DIONE
(6R-trans)-6-(1,3-Benzodioxol-5-yl)-2,3,6,7,12,12a-hexahydro-2-methyl-pyrazino(1',2':1,6)pyrido(3,4-b)indole-1,4-dione
C22H19N3O4
(6R,12aR)-2,3,6,7,12,12a-Hexahydro-2-methyl-6-(3,4-(methylenedioxy)phenyl) pyrazino(1',2':1,6)pyrido(3,4-b)indole-1,4-dione
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|
| has effect |
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|
| binds | |
| has role | |
| DBname |
tadalafil
|
| InChIKey |
InChIKey=WOXKDUGGOYFFRN-IIBYNOLFSA-N
|
| subClassOf | |
| inhibits | |
| is substrate of | |
| type | |
| xref |
National Drug Code Directory:0002-4465-34
Drugs.com:http://www.drugs.com/tadalafil.html
CiteXplore:23234619
CiteXplore:21680058
Reaxys:9589181
CiteXplore:23118430
Patent:EP2238979
DrugBank:DB00820
CiteXplore:23347176
PubChem Compound:110635
PharmGKB:PA10333
CiteXplore:23190275
CiteXplore:22776546
HMDB:HMDB14958
PDB:CIA
CiteXplore:23033484
PDRhealth:http://www.pdrhealth.com/drug_info/rxdrugprofiles/drugs/cia1687.shtml
Wikipedia:http://en.wikipedia.org/wiki/Tadalafil
Patent:WO2005068464
CiteXplore:21056623
BindingDB:14777
Drugs Product Database (DPD):2248088
CiteXplore:22328305
Patent:WO2007113243
CiteXplore:22996758
PubChem Substance:46507646
PDBeChem:CIA
CiteXplore:22971615
CiteXplore:22494518
CiteXplore:23216015
CiteXplore:23219525
RxList:http://www.rxlist.com/cgi/generic3/cialis.htm
Patent:EP2107059
ChemSpider:99301
ChEMBL:144920
KEGG DRUG:D02008
Patent:US2004157847
Patent:WO2010049500
CiteXplore:23312193
CiteXplore:23346990
Patent:US2003229080
CiteXplore:22014651
CiteXplore:23140258
CiteXplore:23072271
Patent:WO2009144734
Patent:WO2012107549
CiteXplore:22816778
CASRN:171596-29-5
CiteXplore:22982422
Wikipedia:Tadalafil
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|
| DBSynonym |
icos 351
tadanafil
|
| AHFScode |
24:12.12
|
| has pharmacological target |
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