The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016

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Preferred Name	sumatriptan
Synonyms	sumatriptanum 3-[2-(dimethylamino)ethyl]-N-methylindole-5-methanesulfonamide (3-[2-(dimethylamino)ethyl]-1H-indol-5-yl)-N-methylmethanesulfonamide 1-{3-[2-(dimethylamino)ethyl]-1H-indol-5-yl}-N-methylmethanesulfonamide Sumax 1-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]-N-methyl-methanesulfonamide sumatriptan Imigran C14H21N3O2S 3-(2-(dimethylamino)ethyl)-N-methyl-1H-indole-5-methanesulfonamide Sumatran Imitrex
ID	http://purl.obolibrary.org/obo/CHEBI_10650
activates	http://purl.obolibrary.org/obo/dinto_0126 http://purl.obolibrary.org/obo/dinto_2858 http://purl.obolibrary.org/obo/dinto_1166 http://purl.obolibrary.org/obo/dinto_3332
AHFScode	28:32.28
ATCCode	N02CC01
CASRN	103628-46-2
DBBrand	sumatran imitrex oral imigran imitrex sumax
DBname	sumatriptan
DBSynonym	np101 triptan sumatriptanum [inn-latin] sumatriptan succinate
Definition	A sulfonamide that consists of N,N-dimethyltryptamine bearing an additional (N-methylsulfamoyl)methyl substituent at position 5. Selective agonist for a vascular 5-HT1 receptor subtype (probably a member of the 5-HT1D family).
has effect	http://purl.obolibrary.org/obo/OAE_0000388 http://purl.obolibrary.org/obo/OAE_0000496 http://purl.obolibrary.org/obo/OAE_0000785 http://purl.obolibrary.org/obo/OAE_0001373 http://purl.obolibrary.org/obo/OAE_0000597 http://purl.obolibrary.org/obo/OAE_0000081 http://purl.obolibrary.org/obo/OAE_0000589 http://purl.obolibrary.org/obo/OAE_0000573 http://purl.obolibrary.org/obo/OAE_0001505 http://purl.obolibrary.org/obo/OAE_0000557 http://purl.obolibrary.org/obo/OAE_0000905 http://purl.obolibrary.org/obo/OAE_0001098 http://purl.obolibrary.org/obo/OAE_0000902 http://purl.obolibrary.org/obo/OAE_0001755 http://purl.obolibrary.org/obo/OAE_0000218 http://purl.obolibrary.org/obo/OAE_0000376 http://purl.obolibrary.org/obo/OAE_0000659 http://purl.obolibrary.org/obo/OAE_0001428 http://purl.obolibrary.org/obo/OAE_0000198 http://purl.obolibrary.org/obo/OAE_0001744 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_0000650 http://purl.obolibrary.org/obo/OAE_0000561 http://purl.obolibrary.org/obo/OAE_0000825 http://purl.obolibrary.org/obo/OAE_0001167 http://purl.obolibrary.org/obo/OAE_0000807 http://purl.obolibrary.org/obo/OAE_0000411 http://purl.obolibrary.org/obo/OAE_0001186 http://purl.obolibrary.org/obo/OAE_0000512 http://purl.obolibrary.org/obo/OAE_0000308 http://purl.obolibrary.org/obo/OAE_0001449 http://purl.obolibrary.org/obo/OAE_0001360 http://purl.obolibrary.org/obo/OAE_0000567 http://purl.obolibrary.org/obo/OAE_0000549 http://purl.obolibrary.org/obo/OAE_0000195 http://purl.obolibrary.org/obo/OAE_0000545 http://purl.obolibrary.org/obo/OAE_0000373 http://purl.obolibrary.org/obo/OAE_0000577 http://purl.obolibrary.org/obo/OAE_0000418 http://purl.obolibrary.org/obo/OAE_0000319 http://purl.obolibrary.org/obo/OAE_0000021 http://purl.obolibrary.org/obo/OAE_0000412 http://purl.obolibrary.org/obo/OAE_0001448 http://purl.obolibrary.org/obo/OAE_0001268 http://purl.obolibrary.org/obo/OAE_0000317 http://purl.obolibrary.org/obo/OAE_0000660 http://purl.obolibrary.org/obo/OAE_0001436 http://purl.obolibrary.org/obo/OAE_0001751 http://purl.obolibrary.org/obo/OAE_0000762 http://purl.obolibrary.org/obo/OAE_0000935 http://purl.obolibrary.org/obo/OAE_0000365 http://purl.obolibrary.org/obo/OAE_0000600 http://purl.obolibrary.org/obo/OAE_0000310 http://purl.obolibrary.org/obo/OAE_0000527 http://purl.obolibrary.org/obo/OAE_0001365 http://purl.obolibrary.org/obo/OAE_0000476 http://purl.obolibrary.org/obo/OAE_0001538 http://purl.obolibrary.org/obo/OAE_0000403 http://purl.obolibrary.org/obo/OAE_0000539 http://purl.obolibrary.org/obo/OAE_0001063 http://purl.obolibrary.org/obo/OAE_0000770 http://purl.obolibrary.org/obo/OAE_0000454 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_0000300 http://purl.obolibrary.org/obo/OAE_0001340 http://purl.obolibrary.org/obo/OAE_0000551 http://purl.obolibrary.org/obo/OAE_0001275 http://purl.obolibrary.org/obo/OAE_0000687 http://purl.obolibrary.org/obo/OAE_0000517 http://purl.obolibrary.org/obo/OAE_0000455 http://purl.obolibrary.org/obo/OAE_0000802 http://purl.obolibrary.org/obo/OAE_0001101 http://purl.obolibrary.org/obo/OAE_0000084 http://purl.obolibrary.org/obo/OAE_0001461 http://purl.obolibrary.org/obo/OAE_0001003 http://purl.obolibrary.org/obo/OAE_0000312 http://purl.obolibrary.org/obo/OAE_0001057 http://purl.obolibrary.org/obo/OAE_0001200 http://purl.obolibrary.org/obo/OAE_0001515 http://purl.obolibrary.org/obo/OAE_0000526 http://purl.obolibrary.org/obo/OAE_0001142 http://purl.obolibrary.org/obo/OAE_0000400 http://purl.obolibrary.org/obo/OAE_0000086 http://purl.obolibrary.org/obo/OAE_0000510 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_0000440 http://purl.obolibrary.org/obo/OAE_0000243 http://purl.obolibrary.org/obo/OAE_0000473 http://purl.obolibrary.org/obo/OAE_0000414 http://purl.obolibrary.org/obo/OAE_0000607 http://purl.obolibrary.org/obo/OAE_0000355 http://purl.obolibrary.org/obo/OAE_0000525 http://purl.obolibrary.org/obo/OAE_0000038 http://purl.obolibrary.org/obo/OAE_0000968 http://purl.obolibrary.org/obo/OAE_0000034 http://purl.obolibrary.org/obo/OAE_0000166 http://purl.obolibrary.org/obo/OAE_0002122 http://purl.obolibrary.org/obo/OAE_0001321 http://purl.obolibrary.org/obo/OAE_0001742 http://purl.obolibrary.org/obo/OAE_0000606 http://purl.obolibrary.org/obo/OAE_0000460 http://purl.obolibrary.org/obo/OAE_0000401 http://purl.obolibrary.org/obo/OAE_0000536 http://purl.obolibrary.org/obo/OAE_0000898 http://purl.obolibrary.org/obo/OAE_0000505 http://purl.obolibrary.org/obo/OAE_0000306 http://purl.obolibrary.org/obo/OAE_0000194 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_0001147 http://purl.obolibrary.org/obo/OAE_0000390 http://purl.obolibrary.org/obo/OAE_0000362 http://purl.obolibrary.org/obo/OAE_0000470 http://purl.obolibrary.org/obo/OAE_0000669 http://purl.obolibrary.org/obo/OAE_0000565 http://purl.obolibrary.org/obo/OAE_0000514 http://purl.obolibrary.org/obo/OAE_0000374 http://purl.obolibrary.org/obo/OAE_0001166 http://purl.obolibrary.org/obo/OAE_0000394 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_0000466 http://purl.obolibrary.org/obo/OAE_0000313 http://purl.obolibrary.org/obo/OAE_0001309 http://purl.obolibrary.org/obo/OAE_0001749 http://purl.obolibrary.org/obo/OAE_0000534 http://purl.obolibrary.org/obo/OAE_0000581 http://purl.obolibrary.org/obo/OAE_0001364 http://purl.obolibrary.org/obo/OAE_0000350
has pharmacological target	http://purl.obolibrary.org/obo/dinto_0126 http://purl.obolibrary.org/obo/dinto_2858 http://purl.obolibrary.org/obo/dinto_1166 http://purl.obolibrary.org/obo/dinto_3332
has role	http://purl.obolibrary.org/obo/CHEBI_35941 http://purl.obolibrary.org/obo/CHEBI_50514
InChI	InChI=1S/C14H21N3O2S/c1-15-20(18,19)10-11-4-5-14-13(8-11)12(9-16-14)6-7-17(2)3/h4-5,8-9,15-16H,6-7,10H2,1-3H3
InChIKey	InChIKey=KQKPFRSPSRPDEB-UHFFFAOYSA-N
induces	http://purl.obolibrary.org/obo/dinto_1987
inhibits	http://purl.obolibrary.org/obo/dinto_1440
is metabolised by	http://purl.obolibrary.org/obo/dinto_3613
is transported by	http://purl.obolibrary.org/obo/dinto_0883 http://purl.obolibrary.org/obo/dinto_2019
label	sumatriptan
may interact with	http://purl.obolibrary.org/obo/CHEBI_32250 http://purl.obolibrary.org/obo/CHEBI_9943 http://purl.obolibrary.org/obo/CHEBI_36791 http://purl.obolibrary.org/obo/CHEBI_7936 http://purl.obolibrary.org/obo/dinto_DB00726 http://purl.obolibrary.org/obo/CHEBI_584020 http://purl.obolibrary.org/obo/CHEBI_7494 http://purl.obolibrary.org/obo/dinto_DB00780 http://purl.obolibrary.org/obo/CHEBI_9654 http://purl.obolibrary.org/obo/dinto_DB01356 http://purl.obolibrary.org/obo/CHEBI_5138 http://purl.obolibrary.org/obo/CHEBI_3723 http://purl.obolibrary.org/obo/dinto_DB01247 http://purl.obolibrary.org/obo/dinto_DB00752 http://purl.obolibrary.org/obo/CHEBI_70707 http://purl.obolibrary.org/obo/CHEBI_10124 http://purl.obolibrary.org/obo/CHEBI_64318 http://purl.obolibrary.org/obo/CHEBI_4562 http://purl.obolibrary.org/obo/CHEBI_5118 http://purl.obolibrary.org/obo/dinto_DB06700
prefixIRI	obo2:CHEBI_10650
prefLabel	sumatriptan
SMILES	CNS(=O)(=O)Cc1ccc2[nH]cc(CCN(C)C)c2c1 CNS(=O)(=O)CC1=CC2=C(NC=C2CCN(C)C)C=C1
Synonym	sumatriptanum 3-[2-(dimethylamino)ethyl]-N-methylindole-5-methanesulfonamide (3-[2-(dimethylamino)ethyl]-1H-indol-5-yl)-N-methylmethanesulfonamide 1-{3-[2-(dimethylamino)ethyl]-1H-indol-5-yl}-N-methylmethanesulfonamide Sumax 1-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]-N-methyl-methanesulfonamide sumatriptan Imigran C14H21N3O2S 3-(2-(dimethylamino)ethyl)-N-methyl-1H-indole-5-methanesulfonamide Sumatran Imitrex
xref	CiteXplore:16120224 CiteXplore:22336849 IUPHAR:119 CiteXplore:18442019 ChEBI:10650 DrugBank:DB00669 CiteXplore:12172708 Wikipedia:Sumatriptan CiteXplore:11045888 Wikipedia:http://en.wikipedia.org/wiki/Sumatriptan ChemSpider:5165 Reaxys:5346011 RxList:http://www.rxlist.com/cgi/generic/sumitr.htm Guide To Pharmacology:119 NIST Chemistry WebBook:103628-46-2 CiteXplore:11401410 Drugs Product Database (DPD):2239738 PharmGKB:PA451566 PubChem Substance:46506520 KEGG DRUG:D00451 ChEMBL:127111 CiteXplore:19825906 CiteXplore:16142613 CiteXplore:22435741 CiteXplore:22150557 CiteXplore:22336867 KEGG COMPOUND:C07319 CiteXplore:22272067 CiteXplore:17557349 CiteXplore:12917936 National Drug Code Directory:0173-0524-00 CiteXplore:22106962 CASRN:103628-46-2 CiteXplore:15652399 PubChem Compound:5358 CiteXplore:19619527 HMDB:HMDB05037 CiteXplore:22302025 Drugs.com:http://www.drugs.com/cdi/sumatriptan.html CiteXplore:22336868 Beilstein:5346011 CiteXplore:12856385
subClassOf	http://purl.obolibrary.org/obo/dinto_000055

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Mapping To	Ontology	Source
http://purl.obolibrary.org/obo/CHEBI_10650	CHEBI	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_10650	PDRO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_10650	FIDEO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_10650	BERO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_10650	BIOMODELS	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_10650	DRON	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_10650	NIFSTD	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_10650	ODNAE	SAME_URI
http://purl.obolibrary.org/obo/XCO_0001225	XCO	LOOM
http://purl.obolibrary.org/obo/CHEBI_10650	CHEBI	LOOM
http://purl.bioontology.org/ontology/NDDF/004044	NDDF	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D02.065.884.750	RH-MESH	LOOM
http://purl.bioontology.org/ontology/LNC/LP28529-3	LOINC	LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0075632	OCHV	LOOM
https://go.drugbank.com/drugs/DB00669	MDM	LOOM
http://purl.bioontology.org/ontology/ATC/N02CC01	ATC	LOOM
http://www.phoc.org.cn/pmo/class/PMO_00015987	PMAPP-PMO	LOOM
http://evs.nci.nih.gov/ftp1/NDF-RT/NDF-RT.owl#N0000148514	ODAE	LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#14885	OCHV	LOOM
http://purl.obolibrary.org/obo/CHEBI_10650	PDRO	LOOM
http://purl.obolibrary.org/obo/CHEBI_10650	FIDEO	LOOM
http://purl.obolibrary.org/obo/CHEBI_10650	BERO	LOOM
http://purl.obolibrary.org/obo/CHEBI_10650	BIOMODELS	LOOM
http://purl.obolibrary.org/obo/CHEBI_10650	DRON	LOOM
http://purl.obolibrary.org/obo/CHEBI_10650	NIFSTD	LOOM
http://purl.obolibrary.org/obo/CHEBI_10650	ODNAE	LOOM
http://purl.bioontology.org/ontology/CSP/5001-0017	CRISP	LOOM
http://purl.obolibrary.org/obo/NCIT_C1240	BERO	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D03.438.473.914.907	RH-MESH	LOOM
http://purl.bioontology.org/ontology/MESH/D018170	MESH	LOOM
http://purl.obolibrary.org/obo/OMIT_0018403	OMIT	LOOM
http://www.co-ode.org/ontologies/galen#Sumatriptan	GALEN	LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000148514	NDFRT	LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/395892000	SNOMEDCT	LOOM
http://www.drugbank.ca/drugs/DB00669	FTC	LOOM
http://purl.bioontology.org/ontology/RXNORM/37418	RXNORM	LOOM
http://purl.obolibrary.org/obo/MESH_D018170	BERO	LOOM
http://purl.jp/bio/4/id/200906051471308579	IOBC	LOOM
http://purl.bioontology.org/ontology/VANDF/4021050	VANDF	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D018170	RH-MESH	LOOM
http://purl.bioontology.org/ontology/LNC/MTHU060536	LOINC	LOOM
http://stirdf.jst.go.jp/id/200907058601449755	IOBC	LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C1240	NCIT	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D02.886.590.700.750	RH-MESH	LOOM