The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016

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Preferred Name	cimetidine
Synonyms	Cimetag cimetidinum cimetidina N-cyano-N'-methyl-N''-(2-([(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl)ethyl)guanidine N''-cyano-N-methyl-N'-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]thio}ethyl)guanidine 2-cyano-1-methyl-3-(2-(((5-methylimidazol-4-yl)methyl)thio)ethyl)guanidine C10H16N6S 2-cyano-1-methyl-3-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)guanidine (Z)-1-cyano-2-methyl-3-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)guanidine Tagamet HB 200 cimetidine Ulcerfen 1-Cyano-2-methyl-3-(2-(((5-methyl-4-imidazolyl)methyl)thio)ethyl)guanidine
ID	http://purl.obolibrary.org/obo/CHEBI_3699
AHFScode	56:28.12
ATCCode	A02BA01
binds	http://purl.obolibrary.org/obo/dinto_2814 http://purl.obolibrary.org/obo/dinto_2651 http://purl.obolibrary.org/obo/dinto_1979 http://purl.obolibrary.org/obo/dinto_1977 http://purl.obolibrary.org/obo/dinto_1972 http://purl.obolibrary.org/obo/dinto_1970 http://purl.obolibrary.org/obo/dinto_1975 http://purl.obolibrary.org/obo/dinto_2667 http://purl.obolibrary.org/obo/dinto_2058 http://purl.obolibrary.org/obo/dinto_2990 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_1812 http://purl.obolibrary.org/obo/dinto_4301 http://purl.obolibrary.org/obo/dinto_0901 http://purl.obolibrary.org/obo/dinto_1440 http://purl.obolibrary.org/obo/dinto_3489 http://purl.obolibrary.org/obo/dinto_1956 http://purl.obolibrary.org/obo/dinto_1221 http://purl.obolibrary.org/obo/dinto_2789 http://purl.obolibrary.org/obo/dinto_0520 http://purl.obolibrary.org/obo/dinto_2808 http://purl.obolibrary.org/obo/dinto_2048 http://purl.obolibrary.org/obo/dinto_2045
blocks	http://purl.obolibrary.org/obo/dinto_2808
CASRN	51481-61-9
DBBrand	ulcomedina ulcofalk tagamet hb 200 acinil ulhys eureceptor ulcedine acibilin tratul peptol tagamet edalene ulcimet cimetum tagamet hb ulcedin gastromet cimetag ulcomet tametin dyspamet
DBname	cimetidine
DBSynonym	cimetidine hcl
Definition	An alkyl sulfide that has formula C10H16N6S.
has effect	http://purl.obolibrary.org/obo/OAE_0000388 http://purl.obolibrary.org/obo/OAE_0001297 http://purl.obolibrary.org/obo/OAE_0000449 http://purl.obolibrary.org/obo/OAE_0000377 http://purl.obolibrary.org/obo/OAE_0000391 http://purl.obolibrary.org/obo/OAE_0000218 http://purl.obolibrary.org/obo/OAE_0000596 http://purl.obolibrary.org/obo/OAE_0000921 http://purl.obolibrary.org/obo/OAE_0000512 http://purl.obolibrary.org/obo/OAE_0001489 http://purl.obolibrary.org/obo/OAE_0000415 http://purl.obolibrary.org/obo/OAE_0000195 http://purl.obolibrary.org/obo/OAE_0001448 http://purl.obolibrary.org/obo/OAE_0000365 http://purl.obolibrary.org/obo/OAE_0000287 http://purl.obolibrary.org/obo/OAE_0000375 http://purl.obolibrary.org/obo/OAE_0000300 http://purl.obolibrary.org/obo/OAE_0001275 http://purl.obolibrary.org/obo/OAE_0000268 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_0000355 http://purl.obolibrary.org/obo/OAE_0000866 http://purl.obolibrary.org/obo/OAE_0001336 http://purl.obolibrary.org/obo/OAE_0000385 http://purl.obolibrary.org/obo/OAE_0001217 http://purl.obolibrary.org/obo/OAE_0000362 http://purl.obolibrary.org/obo/OAE_0000565 http://purl.obolibrary.org/obo/OAE_0001001 http://purl.obolibrary.org/obo/OAE_0000881
has pharmacological target	http://purl.obolibrary.org/obo/dinto_2808
has role	http://purl.obolibrary.org/obo/CHEBI_50183 http://purl.obolibrary.org/obo/CHEBI_60809 http://purl.obolibrary.org/obo/CHEBI_37961 http://purl.obolibrary.org/obo/CHEBI_35480 http://purl.obolibrary.org/obo/CHEBI_49201
InChI	InChI=1S/C10H16N6S/c1-8-9(16-7-15-8)5-17-4-3-13-10(12-2)14-6-11/h7H,3-5H2,1-2H3,(H,15,16)(H2,12,13,14)
InChIKey	InChIKey=AQIXAKUUQRKLND-UHFFFAOYSA-N
induces	http://purl.obolibrary.org/obo/dinto_1440
inhibits	http://purl.obolibrary.org/obo/dinto_2814 http://purl.obolibrary.org/obo/dinto_2651 http://purl.obolibrary.org/obo/dinto_1979 http://purl.obolibrary.org/obo/dinto_1977 http://purl.obolibrary.org/obo/dinto_1972 http://purl.obolibrary.org/obo/dinto_1970 http://purl.obolibrary.org/obo/dinto_1975 http://purl.obolibrary.org/obo/dinto_2667 http://purl.obolibrary.org/obo/dinto_2058 http://purl.obolibrary.org/obo/dinto_2990 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_1812 http://purl.obolibrary.org/obo/dinto_4301 http://purl.obolibrary.org/obo/dinto_0901 http://purl.obolibrary.org/obo/dinto_1440 http://purl.obolibrary.org/obo/dinto_3489 http://purl.obolibrary.org/obo/dinto_1956 http://purl.obolibrary.org/obo/dinto_1221 http://purl.obolibrary.org/obo/dinto_2789 http://purl.obolibrary.org/obo/dinto_0520
is metabolised by	http://purl.obolibrary.org/obo/dinto_2048 http://purl.obolibrary.org/obo/dinto_2045
is substrate of	http://purl.obolibrary.org/obo/dinto_2048 http://purl.obolibrary.org/obo/dinto_2045 http://purl.obolibrary.org/obo/dinto_1979 http://purl.obolibrary.org/obo/dinto_1977 http://purl.obolibrary.org/obo/dinto_1972 http://purl.obolibrary.org/obo/dinto_1970 http://purl.obolibrary.org/obo/dinto_1975 http://purl.obolibrary.org/obo/dinto_1440 http://purl.obolibrary.org/obo/dinto_0520
is transported by	http://purl.obolibrary.org/obo/dinto_1979 http://purl.obolibrary.org/obo/dinto_1977 http://purl.obolibrary.org/obo/dinto_1972 http://purl.obolibrary.org/obo/dinto_1970 http://purl.obolibrary.org/obo/dinto_1975 http://purl.obolibrary.org/obo/dinto_1440 http://purl.obolibrary.org/obo/dinto_0520
label	cimetidine
may interact with	http://purl.obolibrary.org/obo/dinto_DB00683 http://purl.obolibrary.org/obo/CHEBI_71219 http://purl.obolibrary.org/obo/CHEBI_32250 http://purl.obolibrary.org/obo/dinto_DB01303 http://purl.obolibrary.org/obo/dinto_DB00801 http://purl.obolibrary.org/obo/CHEBI_157175 http://purl.obolibrary.org/obo/CHEBI_8107 http://purl.obolibrary.org/obo/CHEBI_16714 http://purl.obolibrary.org/obo/CHEBI_41774 http://purl.obolibrary.org/obo/dinto_DB01587 http://purl.obolibrary.org/obo/dinto_DB01142 http://purl.obolibrary.org/obo/CHEBI_37924 http://purl.obolibrary.org/obo/CHEBI_4888 http://purl.obolibrary.org/obo/CHEBI_8497 http://purl.obolibrary.org/obo/CHEBI_8499 http://purl.obolibrary.org/obo/dinto_DB00344 http://purl.obolibrary.org/obo/CHEBI_9316 http://purl.obolibrary.org/obo/CHEBI_42944 http://purl.obolibrary.org/obo/dinto_DB00540 http://purl.obolibrary.org/obo/dinto_DB01223 http://purl.obolibrary.org/obo/CHEBI_4858 http://purl.obolibrary.org/obo/dinto_DB01192 http://purl.obolibrary.org/obo/CHEBI_8874 http://purl.obolibrary.org/obo/CHEBI_47499 http://purl.obolibrary.org/obo/CHEBI_61049 http://purl.obolibrary.org/obo/dinto_DB00726 http://purl.obolibrary.org/obo/CHEBI_8356 http://purl.obolibrary.org/obo/CHEBI_3756 http://purl.obolibrary.org/obo/CHEBI_47780 http://purl.obolibrary.org/obo/dinto_DB00532 http://purl.obolibrary.org/obo/CHEBI_53289 http://purl.obolibrary.org/obo/dinto_DB00342 http://purl.obolibrary.org/obo/CHEBI_53766 http://purl.obolibrary.org/obo/CHEBI_7582 http://purl.obolibrary.org/obo/CHEBI_3611 http://purl.obolibrary.org/obo/dinto_DB00373 http://purl.obolibrary.org/obo/CHEBI_133809 http://purl.obolibrary.org/obo/CHEBI_7852 http://purl.obolibrary.org/obo/dinto_DB01167 http://purl.obolibrary.org/obo/CHEBI_3766 http://purl.obolibrary.org/obo/CHEBI_3761 http://purl.obolibrary.org/obo/CHEBI_47657 http://purl.obolibrary.org/obo/CHEBI_7565 http://purl.obolibrary.org/obo/CHEBI_75984 http://purl.obolibrary.org/obo/CHEBI_9654 http://purl.obolibrary.org/obo/CHEBI_28502 http://purl.obolibrary.org/obo/dinto_DB01558 http://purl.obolibrary.org/obo/CHEBI_59343 http://purl.obolibrary.org/obo/CHEBI_2611 http://purl.obolibrary.org/obo/CHEBI_4728 http://purl.obolibrary.org/obo/CHEBI_3387 http://purl.obolibrary.org/obo/dinto_DB01588 http://purl.obolibrary.org/obo/CHEBI_3423 http://purl.obolibrary.org/obo/CHEBI_6904 http://purl.obolibrary.org/obo/CHEBI_7454 http://purl.obolibrary.org/obo/CHEBI_9622 http://purl.obolibrary.org/obo/CHEBI_6801 http://purl.obolibrary.org/obo/CHEBI_6807 http://purl.obolibrary.org/obo/CHEBI_64355 http://purl.obolibrary.org/obo/CHEBI_9398 http://purl.obolibrary.org/obo/CHEBI_63629 http://purl.obolibrary.org/obo/CHEBI_10033 http://purl.obolibrary.org/obo/dinto_DB00382 http://purl.obolibrary.org/obo/dinto_DB01171 http://purl.obolibrary.org/obo/CHEBI_9588 http://purl.obolibrary.org/obo/CHEBI_47898 http://purl.obolibrary.org/obo/CHEBI_28593 http://purl.obolibrary.org/obo/CHEBI_70707 http://purl.obolibrary.org/obo/CHEBI_27808 http://purl.obolibrary.org/obo/CHEBI_9139 http://purl.obolibrary.org/obo/CHEBI_4513 http://purl.obolibrary.org/obo/CHEBI_49575 http://purl.obolibrary.org/obo/dinto_DB00690 http://purl.obolibrary.org/obo/dinto_DB01320 http://purl.obolibrary.org/obo/CHEBI_7575 http://purl.obolibrary.org/obo/CHEBI_10102 http://purl.obolibrary.org/obo/CHEBI_6343 http://purl.obolibrary.org/obo/dinto_DB01026 http://purl.obolibrary.org/obo/CHEBI_8428 http://purl.obolibrary.org/obo/CHEBI_2896 http://purl.obolibrary.org/obo/CHEBI_119915 http://purl.obolibrary.org/obo/CHEBI_6456 http://purl.obolibrary.org/obo/CHEBI_28177 http://purl.obolibrary.org/obo/dinto_DB01589 http://purl.obolibrary.org/obo/CHEBI_47781 http://purl.obolibrary.org/obo/dinto_DB01346 http://purl.obolibrary.org/obo/CHEBI_9674 http://purl.obolibrary.org/obo/dinto_DB06210 http://purl.obolibrary.org/obo/dinto_DB01341 http://purl.obolibrary.org/obo/CHEBI_4681 http://purl.obolibrary.org/obo/CHEBI_2675 http://purl.obolibrary.org/obo/CHEBI_2569 http://purl.obolibrary.org/obo/CHEBI_2666
modulates	http://purl.obolibrary.org/obo/dinto_2808
prefixIRI	obo2:CHEBI_3699
prefLabel	cimetidine
SMILES	CN\\C(NCCSCc1nc[nH]c1C)=N\\C#N C\N=C(\NCCSCC1=C(C)NC=N1)NC#N
Synonym	Cimetag cimetidinum cimetidina N-cyano-N'-methyl-N''-(2-([(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl)ethyl)guanidine N''-cyano-N-methyl-N'-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]thio}ethyl)guanidine 2-cyano-1-methyl-3-(2-(((5-methylimidazol-4-yl)methyl)thio)ethyl)guanidine C10H16N6S 2-cyano-1-methyl-3-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)guanidine (Z)-1-cyano-2-methyl-3-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)guanidine Tagamet HB 200 cimetidine Ulcerfen 1-Cyano-2-methyl-3-(2-(((5-methyl-4-imidazolyl)methyl)thio)ethyl)guanidine
xref	National Drug Code Directory:0093-8181-01 Drugs Product Database (DPD):749494 KEGG DRUG:D00295 Wikipedia:http://en.wikipedia.org/wiki/Cimetidine DrugBank:DB00501 PharmGKB:PA449001 ChemSpider:2654 Guide To Pharmacology:1231 ChEMBL:101620 PubChem Substance:46505360 PubChem Compound:2756 Reaxys:6516325 NIST Chemistry WebBook:51481-61-9 Patent:BE804144 BindingDB:22889 RxList:http://www.rxlist.com/cgi/generic/cimet.htm IUPHAR:1231 Wikipedia:Cimetidine ChEBI:3699 Patent:US3950333 Drugs.com:http://www.drugs.com/cdi/cimetidine.html CASRN:51481-61-9
subClassOf	http://purl.obolibrary.org/obo/dinto_000055

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Mapping To	Ontology	Source
http://purl.obolibrary.org/obo/CHEBI_3699	DRON	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3699	PDRO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3699	FIDEO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3699	CCONT	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3699	EFO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3699	BERO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3699	EFO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3699	DDSS	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3699	BIOMODELS	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3699	CHEBI	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3699	NIFSTD	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3699	HINO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3699	DRON	SAME_URI
http://purl.bioontology.org/ontology/PDQ/CDR0000039185	PDQ	LOOM
http://ontology.apa.org/apaonto/termsonlyOUT%20(5).owl#Cimetidine	APAONTO	LOOM
http://purl.bioontology.org/ontology/LNC/LP16078-5	LOINC	LOOM
http://purl.bioontology.org/ontology/LNC/MTHU004923	LOINC	LOOM
http://www.semanticweb.org/ontologies/2018/1/ProstateCancer.owl#Cimetidine	PCAO	LOOM
http://stirdf.jst.go.jp/id/200907023209022265	IOBC	LOOM
http://purl.obolibrary.org/obo/XCO_0001145	XCO	LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C374	NCIT	LOOM
http://purl.obolibrary.org/obo/CHEBI_3699	DRON	LOOM
http://purl.obolibrary.org/obo/CHEBI_3699	PDRO	LOOM
http://purl.obolibrary.org/obo/CHEBI_3699	FIDEO	LOOM
http://purl.obolibrary.org/obo/CHEBI_3699	CCONT	LOOM
http://purl.obolibrary.org/obo/CHEBI_3699	EFO	LOOM
http://purl.obolibrary.org/obo/CHEBI_3699	BERO	LOOM
http://purl.obolibrary.org/obo/CHEBI_3699	EFO	LOOM
http://purl.obolibrary.org/obo/CHEBI_3699	DDSS	LOOM
http://purl.obolibrary.org/obo/CHEBI_3699	BIOMODELS	LOOM
http://purl.obolibrary.org/obo/CHEBI_3699	CHEBI	LOOM
http://purl.obolibrary.org/obo/CHEBI_3699	NIFSTD	LOOM
http://purl.obolibrary.org/obo/CHEBI_3699	HINO	LOOM
http://purl.obolibrary.org/obo/CHEBI_3699	DRON	LOOM
http://www.co-ode.org/ontologies/galen#Cimetidine	GALEN	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D03.383.129.308.130	RH-MESH	LOOM
http://purl.obolibrary.org/obo/NCIT_C374	BERO	LOOM
http://purl.jp/bio/4/id/200906083049263898	IOBC	LOOM
http://purl.bioontology.org/ontology/VANDF/4018845	VANDF	LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#2994	OCHV	LOOM
http://purl.obolibrary.org/obo/OMIT_0004245	OMIT	LOOM
http://purl.bioontology.org/ontology/SNMI/C-84010	SNMI	LOOM
http://purl.bioontology.org/ontology/MESH/D002927	MESH	LOOM
http://www.drugbank.ca/drugs/DB00501	FTC	LOOM
http://purl.bioontology.org/ontology/ATC/A02BA01	ATC	LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/373541007	SNOMEDCT	LOOM
http://purl.bioontology.org/ontology/RXNORM/2541	RXNORM	LOOM
https://go.drugbank.com/drugs/DB00501	MDM	LOOM
http://www.phoc.org.cn/pmo/class/PMO_00016006	PMAPP-PMO	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D002927	RH-MESH	LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0008783	OCHV	LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000147147	NDFRT	LOOM
http://purl.bioontology.org/ontology/RCD/a61..	RCD	LOOM
http://purl.obolibrary.org/obo/MESH_D002927	BERO	LOOM
http://purl.bioontology.org/ontology/CSP/1357-0225	CRISP	LOOM
rgo:04957	GAMUTS	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D02.078.370.200	RH-MESH	LOOM