The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016

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Preferred Name	atorvastatin
Synonyms	atorvastatinum atorvastatin (3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid (3R,5R)-7-[3-(anilinocarbonyl)-5-(4-fluorophenyl)-4-phenyl-2-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid atorvastatina C33H35FN2O5 (R-(R,R))-2-(4-Fluorophenyl)-beta,delta-dihydroxy-5-(1-methylethyl)-3-phenyl-4-((phenylamino)carbonyl)-1H-pyrrole-1-heptanoic acid Atorvastatin atorvastatine 7-[2-(4-FLUORO-PHENYL)-5-ISOPROPYL-3-PHENYL-4-PHENYLCARBAMOYL-PYRROL-1-YL]-3,5-DIHYDROXY-HEPTANOIC ACID Atorlip
ID	http://purl.obolibrary.org/obo/CHEBI_39548
activates	http://purl.obolibrary.org/obo/dinto_1446
AHFScode	24:06.08
altId	CHEBI:39538 CHEBI:2910
ATCCode	C10AA05
CASRN	134523-00-5
DBBrand	normalip xanator zurinel torvast sincol tulip totalip lipovastatinklonal lipitor lipotropic hipolixan cardyl atogal sortis lowden xarator liprimar torvacard vastina faboxim
DBname	atorvastatin
DBSalt	atorvastatin calcium
Definition	A dihydroxy monocarboxylic acid that has formula C33H35FN2O5.
has effect	http://purl.obolibrary.org/obo/OAE_0000388 http://purl.obolibrary.org/obo/OAE_0000496 http://purl.obolibrary.org/obo/OAE_0000447 http://purl.obolibrary.org/obo/OAE_0000449 http://purl.obolibrary.org/obo/OAE_0000453 http://purl.obolibrary.org/obo/OAE_0000597 http://purl.obolibrary.org/obo/OAE_0000081 http://purl.obolibrary.org/obo/OAE_0000573 http://purl.obolibrary.org/obo/OAE_0000604 http://purl.obolibrary.org/obo/OAE_0000905 http://purl.obolibrary.org/obo/OAE_0000377 http://purl.obolibrary.org/obo/OAE_0000902 http://purl.obolibrary.org/obo/OAE_0000391 http://purl.obolibrary.org/obo/OAE_0000630 http://purl.obolibrary.org/obo/OAE_0000376 http://purl.obolibrary.org/obo/OAE_0000479 http://purl.obolibrary.org/obo/OAE_0000492 http://purl.obolibrary.org/obo/OAE_0000267 http://purl.obolibrary.org/obo/OAE_0000596 http://purl.obolibrary.org/obo/OAE_0000406 http://purl.obolibrary.org/obo/OAE_0000825 http://purl.obolibrary.org/obo/OAE_0001509 http://purl.obolibrary.org/obo/OAE_0001167 http://purl.obolibrary.org/obo/OAE_0000411 http://purl.obolibrary.org/obo/OAE_0001186 http://purl.obolibrary.org/obo/OAE_0000921 http://purl.obolibrary.org/obo/OAE_0000308 http://purl.obolibrary.org/obo/OAE_0001489 http://purl.obolibrary.org/obo/OAE_0000611 http://purl.obolibrary.org/obo/OAE_0001360 http://purl.obolibrary.org/obo/OAE_0000567 http://purl.obolibrary.org/obo/OAE_0000415 http://purl.obolibrary.org/obo/OAE_0000195 http://purl.obolibrary.org/obo/OAE_0000373 http://purl.obolibrary.org/obo/OAE_0000418 http://purl.obolibrary.org/obo/OAE_0000210 http://purl.obolibrary.org/obo/OAE_0000319 http://purl.obolibrary.org/obo/OAE_0000967 http://purl.obolibrary.org/obo/OAE_0000412 http://purl.obolibrary.org/obo/OAE_0001448 http://purl.obolibrary.org/obo/OAE_0000317 http://purl.obolibrary.org/obo/OAE_0000660 http://purl.obolibrary.org/obo/OAE_0000482 http://purl.obolibrary.org/obo/OAE_0000805 http://purl.obolibrary.org/obo/OAE_0000382 http://purl.obolibrary.org/obo/OAE_0000250 http://purl.obolibrary.org/obo/OAE_0000935 http://purl.obolibrary.org/obo/OAE_0000600 http://purl.obolibrary.org/obo/OAE_0001378 http://purl.obolibrary.org/obo/OAE_0000310 http://purl.obolibrary.org/obo/OAE_0000984 http://purl.obolibrary.org/obo/OAE_0000608 http://purl.obolibrary.org/obo/OAE_0000539 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_0000375 http://purl.obolibrary.org/obo/OAE_0000551 http://purl.obolibrary.org/obo/OAE_0000691 http://purl.obolibrary.org/obo/OAE_0000895 http://purl.obolibrary.org/obo/OAE_0001234 http://purl.obolibrary.org/obo/OAE_0000498 http://purl.obolibrary.org/obo/OAE_0001057 http://purl.obolibrary.org/obo/OAE_0000327 http://purl.obolibrary.org/obo/OAE_0001295 http://purl.obolibrary.org/obo/OAE_0001515 http://purl.obolibrary.org/obo/OAE_0001190 http://purl.obolibrary.org/obo/OAE_0000400 http://purl.obolibrary.org/obo/OAE_0000086 http://purl.obolibrary.org/obo/OAE_0000645 http://purl.obolibrary.org/obo/OAE_0000584 http://purl.obolibrary.org/obo/OAE_0000842 http://purl.obolibrary.org/obo/OAE_0000643 http://purl.obolibrary.org/obo/OAE_0002206 http://purl.obolibrary.org/obo/OAE_0001106 http://purl.obolibrary.org/obo/OAE_0000440 http://purl.obolibrary.org/obo/OAE_0000613 http://purl.obolibrary.org/obo/OAE_0000894 http://purl.obolibrary.org/obo/OAE_0000414 http://purl.obolibrary.org/obo/OAE_0000607 http://purl.obolibrary.org/obo/OAE_0000525 http://purl.obolibrary.org/obo/OAE_0000968 http://purl.obolibrary.org/obo/OAE_0000034 http://purl.obolibrary.org/obo/OAE_0000344 http://purl.obolibrary.org/obo/OAE_0000508 http://purl.obolibrary.org/obo/OAE_0000401 http://purl.obolibrary.org/obo/OAE_0000343 http://purl.obolibrary.org/obo/OAE_0000405 http://purl.obolibrary.org/obo/OAE_0000536 http://purl.obolibrary.org/obo/OAE_0000647 http://purl.obolibrary.org/obo/OAE_0000505 http://purl.obolibrary.org/obo/OAE_0000194 http://purl.obolibrary.org/obo/OAE_0000022 http://purl.obolibrary.org/obo/OAE_0000385 http://purl.obolibrary.org/obo/OAE_0000468 http://purl.obolibrary.org/obo/OAE_0000602 http://purl.obolibrary.org/obo/OAE_0000336 http://purl.obolibrary.org/obo/OAE_0001147 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_0001291 http://purl.obolibrary.org/obo/OAE_0000374 http://purl.obolibrary.org/obo/OAE_0001166 http://purl.obolibrary.org/obo/OAE_0000242 http://purl.obolibrary.org/obo/OAE_0000211 http://purl.obolibrary.org/obo/OAE_0000462 http://purl.obolibrary.org/obo/OAE_0000916 http://purl.obolibrary.org/obo/OAE_0001309 http://purl.obolibrary.org/obo/OAE_0001497 http://purl.obolibrary.org/obo/OAE_0000402 http://purl.obolibrary.org/obo/OAE_0000811 http://purl.obolibrary.org/obo/OAE_0000350
has pharmacological target	http://purl.obolibrary.org/obo/dinto_4019
has role	http://purl.obolibrary.org/obo/CHEBI_35664 http://purl.obolibrary.org/obo/CHEBI_35679
InChI	InChI=1S/C33H35FN2O5/c1-21(2)31-30(33(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)32(23-13-15-24(34)16-14-23)36(31)18-17-26(37)19-27(38)20-28(39)40/h3-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40)/t26-,27-/m1/s1
InChIKey	InChIKey=XUKUURHRXDUEBC-KAYWLYCHSA-N
induces	http://purl.obolibrary.org/obo/dinto_2058 http://purl.obolibrary.org/obo/dinto_0901 http://purl.obolibrary.org/obo/dinto_0465
inhibits	http://purl.obolibrary.org/obo/dinto_2058 http://purl.obolibrary.org/obo/dinto_2993 http://purl.obolibrary.org/obo/dinto_4019 http://purl.obolibrary.org/obo/dinto_2272 http://purl.obolibrary.org/obo/dinto_0291 http://purl.obolibrary.org/obo/dinto_2019 http://purl.obolibrary.org/obo/dinto_1987 http://purl.obolibrary.org/obo/dinto_0901 http://purl.obolibrary.org/obo/dinto_1440 http://purl.obolibrary.org/obo/dinto_1221
is metabolised by	http://purl.obolibrary.org/obo/dinto_1890 http://purl.obolibrary.org/obo/dinto_1892 http://purl.obolibrary.org/obo/dinto_2990 http://purl.obolibrary.org/obo/dinto_0901 http://purl.obolibrary.org/obo/dinto_1956 http://purl.obolibrary.org/obo/dinto_1221 http://purl.obolibrary.org/obo/dinto_0276
is transported by	http://purl.obolibrary.org/obo/dinto_0887 http://purl.obolibrary.org/obo/dinto_1992 http://purl.obolibrary.org/obo/dinto_2019 http://purl.obolibrary.org/obo/dinto_1824 http://purl.obolibrary.org/obo/dinto_2828 http://purl.obolibrary.org/obo/dinto_0300
label	atorvastatin
prefixIRI	obo2:CHEBI_39548
prefLabel	atorvastatin
related with	http://purl.obolibrary.org/obo/dinto_1322
SMILES	CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(O)=O)C1=CC=C(F)C=C1)C1=CC=CC=C1 CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(O)=O
Synonym	atorvastatinum atorvastatin (3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid (3R,5R)-7-[3-(anilinocarbonyl)-5-(4-fluorophenyl)-4-phenyl-2-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoic acid atorvastatina C33H35FN2O5 (R-(R,R))-2-(4-Fluorophenyl)-beta,delta-dihydroxy-5-(1-methylethyl)-3-phenyl-4-((phenylamino)carbonyl)-1H-pyrrole-1-heptanoic acid Atorvastatin atorvastatine 7-[2-(4-FLUORO-PHENYL)-5-ISOPROPYL-3-PHENYL-4-PHENYLCARBAMOYL-PYRROL-1-YL]-3,5-DIHYDROXY-HEPTANOIC ACID Atorlip
xref	PDRhealth:http://www.pdrhealth.com/drug_info/rxdrugprofiles/drugs/lip1230.shtml BindingDB:22164 Drugs Product Database (DPD):2243097 Patent:US5273995 Drugs.com:http://www.drugs.com/atorvastatin.html RxList:http://www.rxlist.com/cgi/generic/atorvastatin.htm PDB:117 Beilstein:8373630 ChEBI:2910 National Drug Code Directory:0071-0155-23 KEGG DRUG:D07474 ChEMBL:517180 PDBeChem:117 Wikipedia:http://en.wikipedia.org/wiki/Atorvastatin Wikipedia:Atorvastatin CASRN:134523-00-5 Patent:EP409281 KEGG COMPOUND:C06834 PharmGKB:PA448500 DrugBank:DB01076
subClassOf	http://purl.obolibrary.org/obo/dinto_000055

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Mapping To	Ontology	Source
http://purl.obolibrary.org/obo/CHEBI_39548	OBA	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548	HOIP	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548	CHEBI	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548	EFO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548	PDRO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548	FIDEO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548	COVID-19	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548	BERO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548	TXPO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548	BIOMODELS	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548	DRON	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548	NIFSTD	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548	DIDEO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_39548	ODNAE	SAME_URI
http://purl.obolibrary.org/obo/XCO_0000628	XCO	LOOM
http://purl.obolibrary.org/obo/CHEBI_39548	EFO	LOOM
http://purl.obolibrary.org/obo/CHEBI_39548	HOIP	LOOM
http://purl.obolibrary.org/obo/CHEBI_39548	CHEBI	LOOM
http://purl.obolibrary.org/obo/CHEBI_39548	OBA	LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0286651	OCHV	LOOM
http://bmi.utah.edu/ontologies/hfontology/C0286651	HFO	LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000022046	NDFRT	LOOM
http://www.ustb.edu.cn/thesauri/tocr/v1/data#C571353432175145004	ACVD_ONTOLOGY	LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#27738	OCHV	LOOM
http://stirdf.jst.go.jp/id/200907015692823190	IOBC	LOOM
http://www.semanticweb.org/admin/ontologies/2022/7/MIO:02122	MIO	LOOM
http://www.semanticweb.org/ontologies/STO.owl#OWLClass_d9c9be28_a87c_4598_bc8a_be2c03034e4f	STO-DRAFT	LOOM
http://www.semanticweb.org/ontologies/STO.owl#OWLClass_d9c9be28_a87c_4598_bc8a_be2c03034e4f	CVAO	LOOM
http://purl.obolibrary.org/obo/NCIT_C61527	BERO	LOOM
http://purl.bioontology.org/ontology/ATC/C10AA05	ATC	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#C065179	RH-MESH	LOOM
http://purl.bioontology.org/ontology/RCD/bxi..	RCD	LOOM
http://purl.bioontology.org/ontology/LNC/LP171386-8	LOINC	LOOM
http://purl.bioontology.org/ontology/RXNORM/83367	RXNORM	LOOM
http://www.co-ode.org/ontologies/galen#Atorvastatin	GALEN	LOOM
http://www.drugbank.ca/drugs/DB01076	FTC	LOOM
http://purl.bioontology.org/ontology/VANDF/4024041	VANDF	LOOM
http://purl.bioontology.org/ontology/CSP/5002-0003	CRISP	LOOM
http://purl.obolibrary.org/obo/CHEBI_39548	PDRO	LOOM
http://purl.obolibrary.org/obo/CHEBI_39548	FIDEO	LOOM
http://purl.obolibrary.org/obo/CHEBI_39548	COVID-19	LOOM
http://purl.obolibrary.org/obo/CHEBI_39548	BERO	LOOM
http://purl.obolibrary.org/obo/CHEBI_39548	TXPO	LOOM
http://purl.obolibrary.org/obo/CHEBI_39548	BIOMODELS	LOOM
http://purl.obolibrary.org/obo/CHEBI_39548	DRON	LOOM
http://purl.obolibrary.org/obo/CHEBI_39548	NIFSTD	LOOM
http://purl.obolibrary.org/obo/CHEBI_39548	DIDEO	LOOM
http://purl.obolibrary.org/obo/CHEBI_39548	ODNAE	LOOM
http://evs.nci.nih.gov/ftp1/NDF-RT/NDF-RT.owl#N0000022046	ODAE	LOOM
http://evs.nci.nih.gov/ftp1/NDF-RT/NDF-RT.owl#N0000022046	OCVDAE	LOOM
http://scai.fraunhofer.de/AlzheimerOntology#Atorvastation	ADO	LOOM
http://purl.bioontology.org/ontology/NDDF/006321	NDDF	LOOM
http://purl.jp/bio/4/id/200906035911642764	IOBC	LOOM
https://go.drugbank.com/drugs/DB01076	MDM	LOOM
http://www.owl-ontologies.com/OntologyXCT.owl#Atorvastatin	CTX	LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C61527	NCIT	LOOM
http://bmi.utah.edu/ontologies/peontology/C0286651	RAO	LOOM
http://purl.bioontology.org/ontology/MESH/D000069059	MESH	LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/373444002	SNOMEDCT	LOOM