The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016

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Preferred Name	methysergide
Synonyms	(+)-N-(1-(Hydroxymethyl)propyl)-1-methyl-D-lysergamide N-(1-(Hydroxymethyl)propyl)-1-methyl-dextro-(+)-lysergamide 9,10-Didehydro-N-(1-(hydroxymethyl)propyl)-1,6-dimethylergoline-8-carboxamide 1-Methyllysergic acid butanolamide C21H27N3O2 metisergida (4R,7R)-N-(1-hydroxybutan-2-yl)-6,11-dimethyl-6,11-diazatetracyclo[7.6.1.0^{2,7}.0^{12,16}]hexadeca-1(16),2,9,12,14-pentaene-4-carboxamide methysergide 1-Methyl-dextro-lysergic acid (+)-1-hydroxy-2-butylamide Methysergide (8R)-N-[1-hydroxymethyl(propyl)]-1,6-dimethyl-9,10-didehydroergoline-8-carboxamide 1-Methylmethylergonovine methysergidum 1-Methyl-D-lysergic acid butanolamide (+)-9,10-Didehydro-N-(1-(hydroxymethyl)propyl)-1,6-dimethylergoline-8beta-carboxamide
ID	http://purl.obolibrary.org/obo/CHEBI_584020
activates	http://purl.obolibrary.org/obo/dinto_1166
AHFScode	12:16.00
altId	CHEBI:6893
ATCCode	N02CA04
binds	http://purl.obolibrary.org/obo/dinto_3340 http://purl.obolibrary.org/obo/dinto_0510 http://purl.obolibrary.org/obo/dinto_1166 http://purl.obolibrary.org/obo/dinto_0392 http://purl.obolibrary.org/obo/dinto_0648
blocks	http://purl.obolibrary.org/obo/dinto_3340 http://purl.obolibrary.org/obo/dinto_0510 http://purl.obolibrary.org/obo/dinto_0392 http://purl.obolibrary.org/obo/dinto_0648
CASRN	361-37-5
DBBrand	desernil deseril deseryl desernyl sansert
DBname	methysergide
DBSynonym	methysergidum [inn-latin] n-(alpha-(hydroxymethyl)propyl)-1-methyl-dextro-lysergamide methyllysergic acid butanolamide n-(1-(hydroxymethyl)propyl)-1-methyl-dextro-(+)-lysergamide methysergid metisergide [dcit] metisergido [inn-spanish]
Definition	A synthetic ergot alkaloid, structurally related to the oxytocic agent methylergonovine and to the potent hallucinogen LSD and used prophylactically to reduce the frequency and intensity of severe vascular headaches.
has effect	http://purl.obolibrary.org/obo/OAE_0000388 http://purl.obolibrary.org/obo/OAE_0000879 http://purl.obolibrary.org/obo/OAE_0000589 http://purl.obolibrary.org/obo/OAE_0000902 http://purl.obolibrary.org/obo/OAE_0000406 http://purl.obolibrary.org/obo/OAE_0001449 http://purl.obolibrary.org/obo/OAE_0000415 http://purl.obolibrary.org/obo/OAE_0000021 http://purl.obolibrary.org/obo/OAE_0001448 http://purl.obolibrary.org/obo/OAE_0000600 http://purl.obolibrary.org/obo/OAE_0000310 http://purl.obolibrary.org/obo/OAE_0000920 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_0001515 http://purl.obolibrary.org/obo/OAE_0002206 http://purl.obolibrary.org/obo/OAE_0000542 http://purl.obolibrary.org/obo/OAE_0000414 http://purl.obolibrary.org/obo/OAE_0000355 http://purl.obolibrary.org/obo/OAE_0000034 http://purl.obolibrary.org/obo/OAE_0000385 http://purl.obolibrary.org/obo/OAE_0000602 http://purl.obolibrary.org/obo/OAE_0001217 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_0000402 http://purl.obolibrary.org/obo/OAE_0001298
has pharmacological target	http://purl.obolibrary.org/obo/dinto_3340 http://purl.obolibrary.org/obo/dinto_0510 http://purl.obolibrary.org/obo/dinto_1166 http://purl.obolibrary.org/obo/dinto_0392 http://purl.obolibrary.org/obo/dinto_0648
has role	http://purl.obolibrary.org/obo/CHEBI_66991 http://purl.obolibrary.org/obo/CHEBI_48279 http://purl.obolibrary.org/obo/CHEBI_50514
InChI	InChI=1S/C21H27N3O2/c1-4-15(12-25)22-21(26)14-8-17-16-6-5-7-18-20(16)13(10-23(18)2)9-19(17)24(3)11-14/h5-8,10,14-15,19,25H,4,9,11-12H2,1-3H3,(H,22,26)/t14-,15?,19-/m1/s1
InChIKey	InChIKey=KPJZHOPZRAFDTN-NQUBZZJWSA-N
label	methysergide
may interact with	http://purl.obolibrary.org/obo/CHEBI_8214 http://purl.obolibrary.org/obo/CHEBI_119486 http://purl.obolibrary.org/obo/CHEBI_119573 http://purl.obolibrary.org/obo/CHEBI_3437 http://purl.obolibrary.org/obo/CHEBI_8499 http://purl.obolibrary.org/obo/CHEBI_520985 http://purl.obolibrary.org/obo/CHEBI_4856 http://purl.obolibrary.org/obo/CHEBI_63622 http://purl.obolibrary.org/obo/CHEBI_3127 http://purl.obolibrary.org/obo/dinto_DB00373 http://purl.obolibrary.org/obo/CHEBI_238698 http://purl.obolibrary.org/obo/CHEBI_48273 http://purl.obolibrary.org/obo/CHEBI_10650 http://purl.obolibrary.org/obo/CHEBI_7478 http://purl.obolibrary.org/obo/CHEBI_3441 http://purl.obolibrary.org/obo/CHEBI_2904 http://purl.obolibrary.org/obo/dinto_DB01361 http://purl.obolibrary.org/obo/dinto_DB01359 http://purl.obolibrary.org/obo/CHEBI_28787 http://purl.obolibrary.org/obo/CHEBI_60072 http://purl.obolibrary.org/obo/CHEBI_3732 http://purl.obolibrary.org/obo/CHEBI_6904 http://purl.obolibrary.org/obo/CHEBI_64355 http://purl.obolibrary.org/obo/CHEBI_55344 http://purl.obolibrary.org/obo/CHEBI_2379 http://purl.obolibrary.org/obo/CHEBI_3082 http://purl.obolibrary.org/obo/dinto_DB01105 http://purl.obolibrary.org/obo/dinto_DB01580 http://purl.obolibrary.org/obo/dinto_DB00199 http://purl.obolibrary.org/obo/CHEBI_7444 http://purl.obolibrary.org/obo/CHEBI_6062 http://purl.obolibrary.org/obo/CHEBI_6061 http://purl.obolibrary.org/obo/CHEBI_31739 http://purl.obolibrary.org/obo/CHEBI_10124 http://purl.obolibrary.org/obo/CHEBI_6343 http://purl.obolibrary.org/obo/CHEBI_50922 http://purl.obolibrary.org/obo/dinto_DB00998 http://purl.obolibrary.org/obo/CHEBI_258351 http://purl.obolibrary.org/obo/dinto_DB00976
modulates	http://purl.obolibrary.org/obo/dinto_3340 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_1166
prefixIRI	obo2:CHEBI_584020
prefLabel	methysergide
SMILES	[H][C@@]12Cc3cn(C)c4cccc(C1=C[C@H](CN2C)C(=O)NC(CC)CO)c34 [H][C@@]12CC3=CN(C)C4=C3C(=CC=C4)C1=C[C@H](CN2C)C(=O)NC(CC)CO
Synonym	(+)-N-(1-(Hydroxymethyl)propyl)-1-methyl-D-lysergamide N-(1-(Hydroxymethyl)propyl)-1-methyl-dextro-(+)-lysergamide 9,10-Didehydro-N-(1-(hydroxymethyl)propyl)-1,6-dimethylergoline-8-carboxamide 1-Methyllysergic acid butanolamide C21H27N3O2 metisergida (4R,7R)-N-(1-hydroxybutan-2-yl)-6,11-dimethyl-6,11-diazatetracyclo[7.6.1.0^{2,7}.0^{12,16}]hexadeca-1(16),2,9,12,14-pentaene-4-carboxamide methysergide 1-Methyl-dextro-lysergic acid (+)-1-hydroxy-2-butylamide Methysergide (8R)-N-[1-hydroxymethyl(propyl)]-1,6-dimethyl-9,10-didehydroergoline-8-carboxamide 1-Methylmethylergonovine methysergidum 1-Methyl-D-lysergic acid butanolamide (+)-9,10-Didehydro-N-(1-(hydroxymethyl)propyl)-1,6-dimethylergoline-8beta-carboxamide
xref	DrugBank:DB00247 RxList:http://www.rxlist.com/cgi/generic3/sansert.htm Wikipedia:http://en.wikipedia.org/wiki/Methysergide PharmGKB:PA164743265 BindingDB:50031942 ChEBI:584020 CASRN:361-37-5 National Drug Code Directory:0078-0058-05 Patent:GB854569 Guide To Pharmacology:134 Patent:US3113133 Drugs Product Database (DPD):27499 KEGG DRUG:D02357 IUPHAR:134 Beilstein:765986 KEGG COMPOUND:C07199
subClassOf	http://purl.obolibrary.org/obo/dinto_000055

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Mapping To	Ontology	Source
http://purl.obolibrary.org/obo/CHEBI_584020	DRON	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_584020	PDRO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_584020	BERO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_584020	DDSS	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_584020	BIOMODELS	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_584020	CHEBI	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_584020	NIFSTD	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_584020	DRON	SAME_URI
http://sbmi.uth.tmc.edu/ontology/ochv#8068	OCHV	LOOM
http://purl.bioontology.org/ontology/NDDF/004806	NDDF	LOOM
rgo:15233	GAMUTS	LOOM
http://purl.obolibrary.org/obo/OMIT_0009840	OMIT	LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C66123	NCIT	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D03.549.439.689	RH-MESH	LOOM
https://go.drugbank.com/drugs/DB00247	MDM	LOOM
http://purl.obolibrary.org/obo/MESH_D008784	BERO	LOOM
http://purl.obolibrary.org/obo/CHEBI_584020	DRON	LOOM
http://purl.obolibrary.org/obo/CHEBI_584020	PDRO	LOOM
http://purl.obolibrary.org/obo/CHEBI_584020	BERO	LOOM
http://purl.obolibrary.org/obo/CHEBI_584020	DDSS	LOOM
http://purl.obolibrary.org/obo/CHEBI_584020	BIOMODELS	LOOM
http://purl.obolibrary.org/obo/CHEBI_584020	CHEBI	LOOM
http://purl.obolibrary.org/obo/CHEBI_584020	NIFSTD	LOOM
http://purl.obolibrary.org/obo/CHEBI_584020	DRON	LOOM
http://purl.bioontology.org/ontology/MESH/D008784	MESH	LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0025842	OCHV	LOOM
http://purl.bioontology.org/ontology/VANDF/4019833	VANDF	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D03.132.327.287.689	RH-MESH	LOOM
http://purl.obolibrary.org/obo/CHEBI_6893	NIFSTD	LOOM
http://www.co-ode.org/ontologies/galen#Methysergide	GALEN	LOOM
http://purl.bioontology.org/ontology/ATC/N02CA04	ATC	LOOM
http://purl.bioontology.org/ontology/SNMI/C-68480	SNMI	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D008784	RH-MESH	LOOM
http://purl.bioontology.org/ontology/RCD/x01RA	RCD	LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000147921	NDFRT	LOOM
http://purl.bioontology.org/ontology/RXNORM/6911	RXNORM	LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/387044000	SNOMEDCT	LOOM
http://www.drugbank.ca/drugs/DB00247	FTC	LOOM
http://www.phoc.org.cn/pmo/class/PMO_00018010	PMAPP-PMO	LOOM
http://purl.obolibrary.org/obo/NCIT_C66123	BERO	LOOM