The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016

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Preferred Name	tegaserod
Synonyms	(E)-1-({[(3Z)-5-(hydroxymethyl)-3H-indol-3-ylidene]methyl}amino)-2-pentylguanidine tegaserodum 2-[(5-methoxy-2,3-dihydro-1H-indol-3-yl)methylene]-N-pentylhydrazinecarboximidamide 1-(((5-Methoxyindol-3-yl)methylene)amino)-3-pentylguanidine tegaserod C16H23N5O
ID	http://purl.obolibrary.org/obo/CHEBI_51043
AHFScode	92:00.00
ATCCode	A06AX06
binds	http://purl.obolibrary.org/obo/dinto_2651 http://purl.obolibrary.org/obo/dinto_2714 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_1221 http://purl.obolibrary.org/obo/dinto_1051 http://purl.obolibrary.org/obo/dinto_0510 http://purl.obolibrary.org/obo/dinto_0392 http://purl.obolibrary.org/obo/dinto_0648
blocks	http://purl.obolibrary.org/obo/dinto_0510 http://purl.obolibrary.org/obo/dinto_0392 http://purl.obolibrary.org/obo/dinto_0648 http://purl.obolibrary.org/obo/dinto_1051
CASRN	189188-57-6
DBBrand	zelnorm zelmac
DBname	tegaserod
DBSynonym	sdz htf 919 tegaserod maleate
Definition	A hydrazine that has formula C16H23N5O.
has effect	http://purl.obolibrary.org/obo/OAE_0000388 http://purl.obolibrary.org/obo/OAE_0000453 http://purl.obolibrary.org/obo/OAE_0001373 http://purl.obolibrary.org/obo/OAE_0000081 http://purl.obolibrary.org/obo/OAE_0000377 http://purl.obolibrary.org/obo/OAE_0001437 http://purl.obolibrary.org/obo/OAE_0000839 http://purl.obolibrary.org/obo/OAE_0000376 http://purl.obolibrary.org/obo/OAE_0000479 http://purl.obolibrary.org/obo/OAE_0000198 http://purl.obolibrary.org/obo/OAE_0000406 http://purl.obolibrary.org/obo/OAE_0000919 http://purl.obolibrary.org/obo/OAE_0000825 http://purl.obolibrary.org/obo/OAE_0000411 http://purl.obolibrary.org/obo/OAE_0000443 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_0000373 http://purl.obolibrary.org/obo/OAE_0000210 http://purl.obolibrary.org/obo/OAE_0000249 http://purl.obolibrary.org/obo/OAE_0000021 http://purl.obolibrary.org/obo/OAE_0001064 http://purl.obolibrary.org/obo/OAE_0000660 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_0000476 http://purl.obolibrary.org/obo/OAE_0000103 http://purl.obolibrary.org/obo/OAE_0000601 http://purl.obolibrary.org/obo/OAE_0000375 http://purl.obolibrary.org/obo/OAE_0001433 http://purl.obolibrary.org/obo/OAE_0000353 http://purl.obolibrary.org/obo/OAE_0000551 http://purl.obolibrary.org/obo/OAE_0000455 http://purl.obolibrary.org/obo/OAE_0000498 http://purl.obolibrary.org/obo/OAE_0000084 http://purl.obolibrary.org/obo/OAE_0001322 http://purl.obolibrary.org/obo/OAE_0000400 http://purl.obolibrary.org/obo/OAE_0000584 http://purl.obolibrary.org/obo/OAE_0002206 http://purl.obolibrary.org/obo/OAE_0000243 http://purl.obolibrary.org/obo/OAE_0000414 http://purl.obolibrary.org/obo/OAE_0000355 http://purl.obolibrary.org/obo/OAE_0001164 http://purl.obolibrary.org/obo/OAE_0000968 http://purl.obolibrary.org/obo/OAE_0000034 http://purl.obolibrary.org/obo/OAE_0002122 http://purl.obolibrary.org/obo/OAE_0000344 http://purl.obolibrary.org/obo/OAE_0000460 http://purl.obolibrary.org/obo/OAE_0000401 http://purl.obolibrary.org/obo/OAE_0000343 http://purl.obolibrary.org/obo/OAE_0001403 http://purl.obolibrary.org/obo/OAE_0000536 http://purl.obolibrary.org/obo/OAE_0000362 http://purl.obolibrary.org/obo/OAE_0000296 http://purl.obolibrary.org/obo/OAE_0000374 http://purl.obolibrary.org/obo/OAE_0000358 http://purl.obolibrary.org/obo/OAE_0001170 http://purl.obolibrary.org/obo/OAE_0000402
has role	http://purl.obolibrary.org/obo/CHEBI_55324 http://purl.obolibrary.org/obo/CHEBI_35941
InChI	InChI=1S/C16H23N5O/c1-2-3-4-7-18-16(17)21-20-10-13-9-19-15-6-5-12(11-22)8-14(13)15/h5-6,8-10,20,22H,2-4,7,11H2,1H3,(H3,17,18,21)/b13-10+ InChI=1S/C16H23N5O/c1-3-4-5-8-18-16(17)21-20-11-12-10-19-15-7-6-13(22-2)9-14(12)15/h6-7,9-11,19H,3-5,8H2,1-2H3,(H3,17,18,21)/b20-11+
InChIKey	InChIKey=URPUECXJHQGUDU-JLHYYAGUSA-N InChIKey=IKBKZGMPCYNSLU-RGVLZGJSSA-N
inhibits	http://purl.obolibrary.org/obo/dinto_2651 http://purl.obolibrary.org/obo/dinto_2714 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_1221
is metabolised by	http://purl.obolibrary.org/obo/dinto_2993
is substrate of	http://purl.obolibrary.org/obo/dinto_2993 http://purl.obolibrary.org/obo/dinto_2714
is transported by	http://purl.obolibrary.org/obo/dinto_2714
label	tegaserod
modulates	http://purl.obolibrary.org/obo/dinto_0510 http://purl.obolibrary.org/obo/dinto_0392 http://purl.obolibrary.org/obo/dinto_0648 http://purl.obolibrary.org/obo/dinto_1051
prefixIRI	obo2:CHEBI_51043
prefLabel	tegaserod
related with	http://purl.obolibrary.org/obo/dinto_1051
SMILES	CCCCCNC(=N)N\\N=C\\c1c[nH]c2ccc(OC)cc12 CCCCC\N=C(/N)NN\C=C1/C=NC2=C1C=C(CO)C=C2
Synonym	(E)-1-({[(3Z)-5-(hydroxymethyl)-3H-indol-3-ylidene]methyl}amino)-2-pentylguanidine tegaserodum 2-[(5-methoxy-2,3-dihydro-1H-indol-3-yl)methylene]-N-pentylhydrazinecarboximidamide 1-(((5-Methoxyindol-3-yl)methylene)amino)-3-pentylguanidine tegaserod C16H23N5O
xref	Wikipedia:http://en.wikipedia.org/wiki/Tegaserod Patent:EP505322 Wikipedia:Tegaserod PubChem Compound:5487301 Drugs Product Database (DPD):2245566 DrugBank:DB01079 KEGG DRUG:D06056 PharmGKB:PA130413154 ChEMBL:222247 RxList:http://www.rxlist.com/cgi/generic3/zelnorm.htm ChEBI:51043 National Drug Code Directory:0078-0355-80 PubChem Substance:46506519 Drugs.com:http://www.drugs.com/cdi/tegaserod.html Patent:US5510353 ChemSpider:4589305 CASRN:145158-71-0
subClassOf	http://purl.obolibrary.org/obo/dinto_000055

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Mapping To	Ontology	Source
http://purl.obolibrary.org/obo/CHEBI_51043	CHEBI	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_51043	CHEBI	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_51043	PDRO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_51043	BERO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_51043	BIOMODELS	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_51043	DRON	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_51043	NIFSTD	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_51043	CHEBI	LOOM
http://purl.obolibrary.org/obo/CHEBI_51043	CHEBI	LOOM
http://purl.obolibrary.org/obo/CHEBI_51043	PDRO	LOOM
http://purl.obolibrary.org/obo/CHEBI_51043	BERO	LOOM
http://purl.obolibrary.org/obo/CHEBI_51043	BIOMODELS	LOOM
http://purl.obolibrary.org/obo/CHEBI_51043	DRON	LOOM
http://purl.obolibrary.org/obo/CHEBI_51043	NIFSTD	LOOM
http://www.drugbank.ca/drugs/DB01079	FTC	LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#38473	OCHV	LOOM
http://purl.bioontology.org/ontology/RXNORM/139778	RXNORM	LOOM
http://purl.obolibrary.org/obo/NCIT_C66583	BERO	LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C66583	NCIT	LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000022286	NDFRT	LOOM
http://www.phoc.org.cn/pmo/class/PMO_00025211	PMAPP-PMO	LOOM
http://purl.bioontology.org/ontology/MESH/C105050	MESH	LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0537147	OCHV	LOOM
http://purl.bioontology.org/ontology/NDDF/009658	NDDF	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#C105050	RH-MESH	LOOM
http://purl.bioontology.org/ontology/VANDF/4024281	VANDF	LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/417025001	SNOMEDCT	LOOM
https://go.drugbank.com/drugs/DB01079	MDM	LOOM
http://purl.bioontology.org/ontology/ATC/A06AX06	ATC	LOOM