The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016
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Preferred Name

letrozole
Synonyms

Letrozol

Letrozole

4-[(4-cyanophenyl)(1H-1,2,4-triazol-1-yl)methyl]benzonitrile

C17H11N5

Femara

4,4'-(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitrile

letrozole
ID

http://purl.obolibrary.org/obo/CHEBI_6413
AHFScode

10:00.00
ATCCode

L02BG04
binds

http://purl.obolibrary.org/obo/dinto_3102

http://purl.obolibrary.org/obo/dinto_2496

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

http://purl.obolibrary.org/obo/dinto_3102
CASRN

112809-51-5
DBBrand

femara
DBname

letrozole
DBSynonym

letrozol
Definition

A triazole that has formula C17H11N5.
has effect

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

http://purl.obolibrary.org/obo/OAE_0000449

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

http://purl.obolibrary.org/obo/OAE_0001505

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

http://purl.obolibrary.org/obo/OAE_0000318

http://purl.obolibrary.org/obo/OAE_0000391

http://purl.obolibrary.org/obo/OAE_0000839

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

http://purl.obolibrary.org/obo/OAE_0000198

http://purl.obolibrary.org/obo/OAE_0001744

http://purl.obolibrary.org/obo/OAE_0000596

http://purl.obolibrary.org/obo/OAE_0000406

http://purl.obolibrary.org/obo/OAE_0001509

http://purl.obolibrary.org/obo/OAE_0000493

http://purl.obolibrary.org/obo/OAE_0001167

http://purl.obolibrary.org/obo/OAE_0000308

http://purl.obolibrary.org/obo/OAE_0001449

http://purl.obolibrary.org/obo/OAE_0001369

http://purl.obolibrary.org/obo/OAE_0000415

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

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

http://purl.obolibrary.org/obo/OAE_0000319

http://purl.obolibrary.org/obo/OAE_0000021

http://purl.obolibrary.org/obo/OAE_0000317

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

http://purl.obolibrary.org/obo/OAE_0001025

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

http://purl.obolibrary.org/obo/OAE_0000310

http://purl.obolibrary.org/obo/OAE_0000050

http://purl.obolibrary.org/obo/OAE_0000207

http://purl.obolibrary.org/obo/OAE_0000608

http://purl.obolibrary.org/obo/OAE_0000403

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

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

http://purl.obolibrary.org/obo/OAE_0000300

http://purl.obolibrary.org/obo/OAE_0001340

http://purl.obolibrary.org/obo/OAE_0000517

http://purl.obolibrary.org/obo/OAE_0000455

http://purl.obolibrary.org/obo/OAE_0001105

http://purl.obolibrary.org/obo/OAE_0000498

http://purl.obolibrary.org/obo/OAE_0000084

http://purl.obolibrary.org/obo/OAE_0000312

http://purl.obolibrary.org/obo/OAE_0001200

http://purl.obolibrary.org/obo/OAE_0001515

http://purl.obolibrary.org/obo/OAE_0001529

http://purl.obolibrary.org/obo/OAE_0000645

http://purl.obolibrary.org/obo/OAE_0001129

http://purl.obolibrary.org/obo/OAE_0000643

http://purl.obolibrary.org/obo/OAE_0001153

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

http://purl.obolibrary.org/obo/OAE_0000533

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

http://purl.obolibrary.org/obo/OAE_0000355

http://purl.obolibrary.org/obo/OAE_0000789

http://purl.obolibrary.org/obo/OAE_0000038

http://purl.obolibrary.org/obo/OAE_0001164

http://purl.obolibrary.org/obo/OAE_0000034

http://purl.obolibrary.org/obo/OAE_0002122

http://purl.obolibrary.org/obo/OAE_0000460

http://purl.obolibrary.org/obo/OAE_0000401

http://purl.obolibrary.org/obo/OAE_0000505

http://purl.obolibrary.org/obo/OAE_0000194

http://purl.obolibrary.org/obo/OAE_0001356

http://purl.obolibrary.org/obo/OAE_0000022

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

http://purl.obolibrary.org/obo/OAE_0000185

http://purl.obolibrary.org/obo/OAE_0000602

http://purl.obolibrary.org/obo/OAE_0000779

http://purl.obolibrary.org/obo/OAE_0000396

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

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

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

http://purl.obolibrary.org/obo/OAE_0000466

http://purl.obolibrary.org/obo/OAE_0001309

http://purl.obolibrary.org/obo/OAE_0000766

http://purl.obolibrary.org/obo/OAE_0000534

http://purl.obolibrary.org/obo/OAE_0001044

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

http://purl.obolibrary.org/obo/OAE_0001298
has pharmacological target

http://purl.obolibrary.org/obo/dinto_3102
has role

http://purl.obolibrary.org/obo/CHEBI_35610

http://purl.obolibrary.org/obo/CHEBI_50790
InChI

InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H
InChIKey

InChIKey=HPJKCIUCZWXJDR-UHFFFAOYSA-N
inhibits

http://purl.obolibrary.org/obo/dinto_3102

http://purl.obolibrary.org/obo/dinto_2496
is metabolised by

http://purl.obolibrary.org/obo/dinto_3102

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

http://purl.obolibrary.org/obo/dinto_2496
is substrate of

http://purl.obolibrary.org/obo/dinto_3102

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

http://purl.obolibrary.org/obo/dinto_2496
label

letrozole
modulates

http://purl.obolibrary.org/obo/dinto_3102
prefixIRI

obo2:CHEBI_6413
prefLabel

letrozole
SMILES

N#Cc1ccc(cc1)C(c1ccc(cc1)C#N)n1cncn1

N#CC1=CC=C(C=C1)C(N1C=NC=N1)C1=CC=C(C=C1)C#N
Synonym

Letrozol

Letrozole

4-[(4-cyanophenyl)(1H-1,2,4-triazol-1-yl)methyl]benzonitrile

C17H11N5

Femara

4,4'-(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitrile

letrozole
xref

Patent:EP236940

PharmGKB:PA450196

ChEBI:6413

DrugBank:DB01006

ChemSpider:3765

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

PubChem Compound:3902

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

ChEMBL:474548

Wikipedia:Letrozole

Drugs Product Database (DPD):2231384

BindingDB:13061

KEGG COMPOUND:C08163

PubChem Substance:46504610

CASRN:112809-51-5

Beilstein:6813913

RxList:http://www.rxlist.com/cgi/generic2/letroz.htm

KEGG DRUG:D00964

Patent:US4978672
subClassOf

http://purl.obolibrary.org/obo/dinto_000055
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Mapping To Ontology Source
http://purl.obolibrary.org/obo/CHEBI_6413 DRON SAME_URI
http://purl.obolibrary.org/obo/CHEBI_6413 DRON SAME_URI
http://purl.obolibrary.org/obo/CHEBI_6413 PDRO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_6413 CHEBI SAME_URI
http://purl.obolibrary.org/obo/CHEBI_6413 BERO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_6413 DDSS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_6413 BIOMODELS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_6413 NIFSTD SAME_URI
http://purl.obolibrary.org/obo/CHEBI_6413 DRON LOOM
http://purl.bioontology.org/ontology/LNC/LP437032-8 LOINC LOOM
http://purl.bioontology.org/ontology/MESH/D000077289 MESH LOOM
http://purl.obolibrary.org/obo/XCO_0001327 XCO LOOM
http://www.phoc.org.cn/pmo/class/PMO_00026175 PMAPP-PMO LOOM
http://purl.bioontology.org/ontology/PDQ/CDR0000042086 PDQ LOOM
http://www.drugbank.ca/drugs/DB01006 FTC LOOM
http://purl.bioontology.org/ontology/LNC/MTHU069929 LOINC LOOM
http://purl.obolibrary.org/obo/NCIT_C1527 BERO LOOM
http://purl.bioontology.org/ontology/NDDF/006298 NDDF LOOM
https://go.drugbank.com/drugs/DB01006 MDM LOOM
http://purl.jp/bio/4/id/200906050381941110 IOBC LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#C067431 RH-MESH LOOM
http://www.co-ode.org/ontologies/galen#Letrozole GALEN LOOM
http://purl.bioontology.org/ontology/RCD/heE.. RCD LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000148513 NDFRT LOOM
http://purl.bioontology.org/ontology/ATC/L02BG04 ATC LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#25142 OCHV LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0246421 OCHV LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C1527 NCIT LOOM
http://purl.obolibrary.org/obo/CHEBI_6413 DRON LOOM
http://purl.obolibrary.org/obo/CHEBI_6413 PDRO LOOM
http://purl.obolibrary.org/obo/CHEBI_6413 CHEBI LOOM
http://purl.obolibrary.org/obo/CHEBI_6413 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_6413 DDSS LOOM
http://purl.obolibrary.org/obo/CHEBI_6413 BIOMODELS LOOM
http://purl.obolibrary.org/obo/CHEBI_6413 NIFSTD LOOM
http://stirdf.jst.go.jp/id/200907081310334197 IOBC LOOM
http://www.semanticweb.org/administrator/ontologies/2022/0/untitled-ontology-34#OWLClass731d61fb_cd1b_4ae6_b7cc_326a9444e994 WWECA LOOM
http://purl.bioontology.org/ontology/RXNORM/72965 NLMVS LOOM
http://purl.bioontology.org/ontology/RXNORM/72965 RXNORM LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/386911004 SNOMEDCT LOOM
http://purl.bioontology.org/ontology/VANDF/4021049 VANDF LOOM