The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016
Preferred Name

zafirlukast
Synonyms

zafirlukast

4-(5-cyclopentyloxycarbonylamino-1-methyl-1H-indol-3-ylmethyl)-3-methoxy-N-o-tolylsulfonylbenzamide

cyclopentyl N-{3-[(2-methoxy-4-{[(2-methylbenzene)sulfonyl]carbamoyl}phenyl)methyl]-1-methyl-1H-indol-5-yl}carbamate

C31H33N3O6S

cyclopentyl 3-[2-methoxy-4-(2-methylphenylsulfonylcarbamoyl)benzyl]-1-methyl-1H-indol-5-ylcarbamate

Accolate

cyclopentyl 3-(2-methoxy-4-((o-tolylsulfonyl)carbamoyl)benzyl)-1-methylindole-5-carbamate

ID

http://purl.obolibrary.org/obo/CHEBI_10100

AHFScode

48:10.24

ATCCode

R03DC01

binds

http://purl.obolibrary.org/obo/dinto_2651

http://purl.obolibrary.org/obo/dinto_2058

http://purl.obolibrary.org/obo/dinto_2993

http://purl.obolibrary.org/obo/dinto_0293

http://purl.obolibrary.org/obo/dinto_0291

http://purl.obolibrary.org/obo/dinto_0901

http://purl.obolibrary.org/obo/dinto_1221

http://purl.obolibrary.org/obo/dinto_3496

http://purl.obolibrary.org/obo/dinto_0883

http://purl.obolibrary.org/obo/dinto_0938

blocks

http://purl.obolibrary.org/obo/dinto_0883

http://purl.obolibrary.org/obo/dinto_3496

CASRN

107753-78-6

DBBrand

accolate

DBname

zafirlukast

DBSynonym

ici-204,219

Definition

A carbamate ester that has formula C31H33N3O6S.

has effect

http://purl.obolibrary.org/obo/OAE_0000388

http://purl.obolibrary.org/obo/OAE_0000453

http://purl.obolibrary.org/obo/OAE_0000303

http://purl.obolibrary.org/obo/OAE_0000377

http://purl.obolibrary.org/obo/OAE_0000376

http://purl.obolibrary.org/obo/OAE_0001360

http://purl.obolibrary.org/obo/OAE_0000373

http://purl.obolibrary.org/obo/OAE_0000418

http://purl.obolibrary.org/obo/OAE_0001013

http://purl.obolibrary.org/obo/OAE_0000210

http://purl.obolibrary.org/obo/OAE_0001448

http://purl.obolibrary.org/obo/OAE_0000382

http://purl.obolibrary.org/obo/OAE_0000600

http://purl.obolibrary.org/obo/OAE_0000920

http://purl.obolibrary.org/obo/OAE_0001026

http://purl.obolibrary.org/obo/OAE_0000632

http://purl.obolibrary.org/obo/OAE_0000601

http://purl.obolibrary.org/obo/OAE_0001463

http://purl.obolibrary.org/obo/OAE_0000375

http://purl.obolibrary.org/obo/OAE_0001003

http://purl.obolibrary.org/obo/OAE_0000268

http://purl.obolibrary.org/obo/OAE_0000584

http://purl.obolibrary.org/obo/OAE_0002206

http://purl.obolibrary.org/obo/OAE_0000414

http://purl.obolibrary.org/obo/OAE_0000647

http://purl.obolibrary.org/obo/OAE_0000385

http://purl.obolibrary.org/obo/OAE_0001217

http://purl.obolibrary.org/obo/OAE_0000390

http://purl.obolibrary.org/obo/OAE_0000362

http://purl.obolibrary.org/obo/OAE_0000565

http://purl.obolibrary.org/obo/OAE_0000374

http://purl.obolibrary.org/obo/OAE_0000402

has pharmacological target

http://purl.obolibrary.org/obo/dinto_3496

has role

http://purl.obolibrary.org/obo/CHEBI_65023

http://purl.obolibrary.org/obo/CHEBI_49159

InChI

InChI=1S/C31H33N3O6S/c1-20-8-4-7-11-29(20)41(37,38)33-30(35)22-13-12-21(28(17-22)39-3)16-23-19-34(2)27-15-14-24(18-26(23)27)32-31(36)40-25-9-5-6-10-25/h4,7-8,11-15,17-19,25H,5-6,9-10,16H2,1-3H3,(H,32,36)(H,33,35)

InChIKey

InChIKey=YEEZWCHGZNKEEK-UHFFFAOYSA-N

inhibits

http://purl.obolibrary.org/obo/dinto_2651

http://purl.obolibrary.org/obo/dinto_2058

http://purl.obolibrary.org/obo/dinto_2993

http://purl.obolibrary.org/obo/dinto_0293

http://purl.obolibrary.org/obo/dinto_0291

http://purl.obolibrary.org/obo/dinto_0901

http://purl.obolibrary.org/obo/dinto_1221

is metabolised by

http://purl.obolibrary.org/obo/dinto_2058

http://purl.obolibrary.org/obo/dinto_0901

http://purl.obolibrary.org/obo/dinto_1221

http://purl.obolibrary.org/obo/dinto_0938

is substrate of

http://purl.obolibrary.org/obo/dinto_2058

http://purl.obolibrary.org/obo/dinto_0901

http://purl.obolibrary.org/obo/dinto_1221

http://purl.obolibrary.org/obo/dinto_0938

label

zafirlukast

may interact with

http://purl.obolibrary.org/obo/CHEBI_31348

http://purl.obolibrary.org/obo/CHEBI_119573

http://purl.obolibrary.org/obo/CHEBI_5296

http://purl.obolibrary.org/obo/dinto_DB00196

http://purl.obolibrary.org/obo/dinto_DB01223

http://purl.obolibrary.org/obo/CHEBI_53766

http://purl.obolibrary.org/obo/dinto_DB06268

http://purl.obolibrary.org/obo/CHEBI_47657

http://purl.obolibrary.org/obo/CHEBI_60761

http://purl.obolibrary.org/obo/CHEBI_3720

http://purl.obolibrary.org/obo/CHEBI_102484

http://purl.obolibrary.org/obo/dinto_DB00199

http://purl.obolibrary.org/obo/dinto_DB01026

http://purl.obolibrary.org/obo/CHEBI_28177

http://purl.obolibrary.org/obo/CHEBI_27999

http://purl.obolibrary.org/obo/CHEBI_46345

http://purl.obolibrary.org/obo/CHEBI_9328

http://purl.obolibrary.org/obo/dinto_DB00622

modulates

http://purl.obolibrary.org/obo/dinto_0883

http://purl.obolibrary.org/obo/dinto_3496

prefixIRI

obo2:CHEBI_10100

prefLabel

zafirlukast

SMILES

COc1cc(ccc1Cc1cn(C)c2ccc(NC(=O)OC3CCCC3)cc12)C(=O)NS(=O)(=O)c1ccccc1C

COC1=C(CC2=CN(C)C3=C2C=C(NC(=O)OC2CCCC2)C=C3)C=CC(=C1)C(=O)NS(=O)(=O)C1=CC=CC=C1C

Synonym

zafirlukast

4-(5-cyclopentyloxycarbonylamino-1-methyl-1H-indol-3-ylmethyl)-3-methoxy-N-o-tolylsulfonylbenzamide

cyclopentyl N-{3-[(2-methoxy-4-{[(2-methylbenzene)sulfonyl]carbamoyl}phenyl)methyl]-1-methyl-1H-indol-5-yl}carbamate

C31H33N3O6S

cyclopentyl 3-[2-methoxy-4-(2-methylphenylsulfonylcarbamoyl)benzyl]-1-methyl-1H-indol-5-ylcarbamate

Accolate

cyclopentyl 3-(2-methoxy-4-((o-tolylsulfonyl)carbamoyl)benzyl)-1-methylindole-5-carbamate

xref

ChEBI:10100

KEGG COMPOUND:C07206

RxList:http://www.rxlist.com/cgi/generic/zafirlukast.htm

Drugs.com:http://www.drugs.com/cdi/zafirlukast.html

PubChem Substance:46506874

ChemSpider:5515

National Drug Code Directory:0310-0401-60

Guide To Pharmacology:3322

Beilstein:3641829

Wikipedia:Zafirlukast

CASRN:107753-78-6

KEGG DRUG:D00411

PharmGKB:PA451949

IUPHAR:3322

PubChem Compound:5717

ChEMBL:121523

Wikipedia:http://en.wikipedia.org/wiki/Zafirlukast

DrugBank:DB00549

Drugs Product Database (DPD):2236606

subClassOf

http://purl.obolibrary.org/obo/dinto_000055

Delete Subject Author Type Created
No notes to display
Create mapping

Mapping To Ontology Source
http://purl.obolibrary.org/obo/CHEBI_10100 CHEBI SAME_URI
http://purl.obolibrary.org/obo/CHEBI_10100 DRON SAME_URI
http://purl.obolibrary.org/obo/CHEBI_10100 PDRO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_10100 FIDEO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_10100 HOIP SAME_URI
http://purl.obolibrary.org/obo/CHEBI_10100 COVID-19 SAME_URI
http://purl.obolibrary.org/obo/CHEBI_10100 BERO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_10100 DDSS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_10100 TXPO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_10100 BIOMODELS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_10100 NIFSTD SAME_URI
http://purl.obolibrary.org/obo/CHEBI_10100 ODNAE SAME_URI
http://purl.obolibrary.org/obo/XCO_0001263 XCO LOOM
http://purl.bioontology.org/ontology/PDQ/CDR0000790373 PDQ LOOM
http://purl.obolibrary.org/obo/CHEBI_10100 DRON LOOM
http://purl.obolibrary.org/obo/CHEBI_10100 CHEBI LOOM
http://purl.obolibrary.org/obo/XCO_0001263 XCO LOOM
http://purl.obolibrary.org/obo/CHEBI_10100 PDRO LOOM
http://purl.obolibrary.org/obo/CHEBI_10100 FIDEO LOOM
http://purl.obolibrary.org/obo/CHEBI_10100 HOIP LOOM
http://purl.obolibrary.org/obo/CHEBI_10100 COVID-19 LOOM
http://purl.obolibrary.org/obo/CHEBI_10100 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_10100 DDSS LOOM
http://purl.obolibrary.org/obo/CHEBI_10100 TXPO LOOM
http://purl.obolibrary.org/obo/CHEBI_10100 BIOMODELS LOOM
http://purl.obolibrary.org/obo/CHEBI_10100 NIFSTD LOOM
http://purl.obolibrary.org/obo/CHEBI_10100 ODNAE LOOM
http://purl.bioontology.org/ontology/VANDF/4020987 VANDF LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000148457 NDFRT LOOM
http://stirdf.jst.go.jp/id/200907006403718007 IOBC LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C47785 NCIT LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/386880006 SNOMEDCT LOOM
http://purl.bioontology.org/ontology/NDDF/006206 NDDF LOOM
http://www.phoc.org.cn/pmo/class/PMO_00026766 PMAPP-PMO LOOM
http://evs.nci.nih.gov/ftp1/NDF-RT/NDF-RT.owl#N0000148457 ODAE LOOM
http://purl.jp/bio/4/id/200906019940367106 IOBC LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#31897 OCHV LOOM
http://www.co-ode.org/ontologies/galen#Zafirlukast GALEN LOOM
http://purl.bioontology.org/ontology/RCD/cA2.. RCD LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0378466 OCHV LOOM
http://purl.bioontology.org/ontology/RXNORM/114970 RXNORM LOOM
http://www.drugbank.ca/drugs/DB00549 FTC LOOM
http://purl.bioontology.org/ontology/MESH/C062735 MESH LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#C062735 RH-MESH LOOM
http://purl.bioontology.org/ontology/PDQ/CDR0000790373 PDQ LOOM
http://purl.bioontology.org/ontology/ATC/R03DC01 ATC LOOM
http://childhealthservicemodels.eu/asthma#MOCHA-Asthma_000120 AO LOOM
http://purl.obolibrary.org/obo/NCIT_C47785 BERO LOOM
https://go.drugbank.com/drugs/DB00549 MDM LOOM