The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016

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Preferred Name	doxycycline
Synonyms	Vibramycin doxycyclinum Jenacyclin C22H24N2O8 5-hydroxy-alpha-6-deoxytetracycline doxycycline (anhydrous) doxiciclina Doxycyclin (4S,4AR,5S,5AR,6R,12AS)-4-(DIMETHYLAMINO)-3,5,10,12,12A-PENTAHYDROXY-6-METHYL-1,11-DIOXO-1,4,4A,5,5A,6,11,12A-OCTAHYDROTETRACENE-2-CARBOXAMIDE doxycycline (4S,4aR,5S,5aR,6R,12aS)-4-(dimethylamino)-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide Doxycycline 6alpha-deoxy-5-oxytetracycline Supracyclin
ID	http://purl.obolibrary.org/obo/CHEBI_50845
AHFScode	52:04.04 08:12.24
altId	CHEBI:4713 CHEBI:42135
ATCCode	A01AB22 J01AA02
CASRN	564-25-0
DBBrand	doxy-caps atridox monodox doxytec doxylin apo-doxy doxychel doxy 100 alti-doxycycline doxy-lemmon supracyclin novo-doxylin doxycin nu-doxycycline doryx oracea jenacyclin vibramycin vibra-tabs doxychel hyclate periostat
DBname	doxycycline
DBSynonym	doxycycline hyclate doxytetracycline doxcycline anhydrous doxycycline monohydrate
Definition	Tetracycline in which the 5beta-hydrogen is replaced by a hydroxy group, while the 6alpha-hydroxy group is replaced by hydrogen. A semi-synthetic tetracycline antibiotic, it is used to inhibit bacterial protein synthesis and treat non-gonococcal urethritis and cervicitis, exacerbations of bronchitis in patients with chronic obstructive pulmonary disease (COPD), and adult periodontitis.
has pharmacological target	http://purl.obolibrary.org/obo/dinto_2863 http://purl.obolibrary.org/obo/dinto_2852 http://purl.obolibrary.org/obo/dinto_0908
has role	http://purl.obolibrary.org/obo/CHEBI_36047 http://purl.obolibrary.org/obo/CHEBI_38068
InChI	InChI=1S/C22H24N2O8/c1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)17(27)14-15(24(2)3)18(28)13(21(23)31)20(30)22(14,32)19(12)29/h4-7,10,14-15,17,25,27-29,32H,1-3H3,(H2,23,31)/t7-,10+,14+,15-,17-,22-/m0/s1
InChIKey	InChIKey=JBIWCJUYHHGXTC-AKNGSSGZSA-N
inhibits	http://purl.obolibrary.org/obo/dinto_1975 http://purl.obolibrary.org/obo/dinto_2863 http://purl.obolibrary.org/obo/dinto_2852 http://purl.obolibrary.org/obo/dinto_4301 http://purl.obolibrary.org/obo/dinto_0908 http://purl.obolibrary.org/obo/dinto_0901 http://purl.obolibrary.org/obo/dinto_0520
label	doxycycline
may interact with	http://purl.obolibrary.org/obo/CHEBI_7809 http://purl.obolibrary.org/obo/CHEBI_102524 http://purl.obolibrary.org/obo/CHEBI_5098 http://purl.obolibrary.org/obo/dinto_DB01604 http://purl.obolibrary.org/obo/CHEBI_8107 http://purl.obolibrary.org/obo/dinto_DB00417 http://purl.obolibrary.org/obo/dinto_DB00794 http://purl.obolibrary.org/obo/CHEBI_102166 http://purl.obolibrary.org/obo/CHEBI_44185 http://purl.obolibrary.org/obo/dinto_DB00306 http://purl.obolibrary.org/obo/CHEBI_4888 http://purl.obolibrary.org/obo/CHEBI_5683 http://purl.obolibrary.org/obo/CHEBI_2956 http://purl.obolibrary.org/obo/CHEBI_50859 http://purl.obolibrary.org/obo/dinto_DB01355 http://purl.obolibrary.org/obo/CHEBI_4913 http://purl.obolibrary.org/obo/CHEBI_18208 http://purl.obolibrary.org/obo/CHEBI_102216 http://purl.obolibrary.org/obo/dinto_DB00893 http://purl.obolibrary.org/obo/CHEBI_3393 http://purl.obolibrary.org/obo/dinto_DB00532 http://purl.obolibrary.org/obo/CHEBI_8069 http://purl.obolibrary.org/obo/dinto_DB00312 http://purl.obolibrary.org/obo/CHEBI_161680 http://purl.obolibrary.org/obo/CHEBI_53766 http://purl.obolibrary.org/obo/dinto_DB00258 http://purl.obolibrary.org/obo/dinto_DB01370 http://purl.obolibrary.org/obo/CHEBI_50173 http://purl.obolibrary.org/obo/dinto_DB01354 http://purl.obolibrary.org/obo/CHEBI_133809 http://purl.obolibrary.org/obo/CHEBI_28971 http://purl.obolibrary.org/obo/CHEBI_31794 http://purl.obolibrary.org/obo/dinto_DB01574 http://purl.obolibrary.org/obo/CHEBI_48947 http://purl.obolibrary.org/obo/dinto_DB01357 http://purl.obolibrary.org/obo/CHEBI_59594 http://purl.obolibrary.org/obo/dinto_DB00237 http://purl.obolibrary.org/obo/dinto_DB01352 http://purl.obolibrary.org/obo/dinto_DB01593 http://purl.obolibrary.org/obo/CHEBI_15367 http://purl.obolibrary.org/obo/CHEBI_6919 http://purl.obolibrary.org/obo/CHEBI_6758 http://purl.obolibrary.org/obo/CHEBI_6827 http://purl.obolibrary.org/obo/CHEBI_3387 http://purl.obolibrary.org/obo/dinto_DB01378 http://purl.obolibrary.org/obo/CHEBI_9622 http://purl.obolibrary.org/obo/CHEBI_45367 http://purl.obolibrary.org/obo/CHEBI_9398 http://purl.obolibrary.org/obo/CHEBI_10033 http://purl.obolibrary.org/obo/dinto_DB01351 http://purl.obolibrary.org/obo/CHEBI_9587 http://purl.obolibrary.org/obo/CHEBI_49566 http://purl.obolibrary.org/obo/dinto_DB01606 http://purl.obolibrary.org/obo/dinto_DB01164 http://purl.obolibrary.org/obo/CHEBI_7447 http://purl.obolibrary.org/obo/CHEBI_31444 http://purl.obolibrary.org/obo/dinto_DB00977 http://purl.obolibrary.org/obo/CHEBI_4513 http://purl.obolibrary.org/obo/CHEBI_4511 http://purl.obolibrary.org/obo/CHEBI_6067 http://purl.obolibrary.org/obo/dinto_DB01373 http://purl.obolibrary.org/obo/dinto_DB01320 http://purl.obolibrary.org/obo/CHEBI_28077 http://purl.obolibrary.org/obo/dinto_DB01592 http://purl.obolibrary.org/obo/CHEBI_8232 http://purl.obolibrary.org/obo/dinto_DB01346 http://purl.obolibrary.org/obo/dinto_DB01353 http://purl.obolibrary.org/obo/CHEBI_2968 http://purl.obolibrary.org/obo/dinto_DB01341 http://purl.obolibrary.org/obo/CHEBI_51210 http://purl.obolibrary.org/obo/CHEBI_9073 http://purl.obolibrary.org/obo/CHEBI_2676
prefixIRI	obo2:CHEBI_50845
prefLabel	doxycycline
SMILES	[H][C@@]12[C@@H](C)c3cccc(O)c3C(=O)C1=C(O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@]1([H])[C@H]2O [H][C@@]12[C@@H](C)C3=C(C(O)=CC=C3)C(=O)C1=C(O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@]1([H])[C@H]2O
Synonym	Vibramycin doxycyclinum Jenacyclin C22H24N2O8 5-hydroxy-alpha-6-deoxytetracycline doxycycline (anhydrous) doxiciclina Doxycyclin (4S,4AR,5S,5AR,6R,12AS)-4-(DIMETHYLAMINO)-3,5,10,12,12A-PENTAHYDROXY-6-METHYL-1,11-DIOXO-1,4,4A,5,5A,6,11,12A-OCTAHYDROTETRACENE-2-CARBOXAMIDE doxycycline (4S,4aR,5S,5aR,6R,12aS)-4-(dimethylamino)-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide Doxycycline 6alpha-deoxy-5-oxytetracycline Supracyclin
xref	Drugs Product Database (DPD):742562 Beilstein:3041790 Drugs.com:http://www.drugs.com/doxycycline.html Reaxys:3041790 Wikipedia:http://en.wikipedia.org/wiki/Doxycycline KEGG COMPOUND:C06973 Wikipedia:Doxycycline PDBeChem:DXT PubChem Compound:5281011 PharmGKB:PA449415 BindingDB:50041429 ChEMBL:471546 Patent:US3200149 PubChem Substance:46506491 DrugBank:DB00254 National Drug Code Directory:49884-091-01 CiteXplore:1650428 Patent:US3019260 KEGG DRUG:D07876 CASRN:564-25-0 RxList:http://www.rxlist.com/cgi/generic/doxycyc.htm ChEBI:50845 ChemSpider:4444486
subClassOf	http://purl.obolibrary.org/obo/dinto_000055

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Mapping To	Ontology	Source
http://purl.obolibrary.org/obo/CHEBI_50845	XCO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_50845	EFO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_50845	PHIPO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_50845	CHEBI	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_50845	PDRO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_50845	FIDEO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_50845	BERO	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_50845	BIOMODELS	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_50845	DRON	SAME_URI
http://purl.obolibrary.org/obo/CHEBI_50845	NIFSTD	SAME_URI
http://purl.obolibrary.org/obo/XCO_0000671	XCO	LOOM
http://purl.obolibrary.org/obo/CHEBI_50845	EFO	LOOM
http://purl.obolibrary.org/obo/CHEBI_50845	PHIPO	LOOM
http://purl.obolibrary.org/obo/CHEBI_50845	CHEBI	LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000146109	NDFRT	LOOM
http://purl.bioontology.org/ontology/RCD/e75..	RCD	LOOM
http://purl.bioontology.org/ontology/ATC/J01AA02	ATC	LOOM
http://purl.bioontology.org/ontology/VANDF/4017742	VANDF	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D004318	RH-MESH	LOOM
http://purl.bioontology.org/ontology/LNC/MTHU002295	LOINC	LOOM
https://github.com/sap218/ocimido/blob/master/ontology/ocimido.owl#OCIMIDO_00585	OCIMIDO	LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0013090	OCHV	LOOM
http://bmi.utah.edu/ontologies/peontology/C0013090	RAO	LOOM
http://purl.jp/bio/4/id/200906074046684389	IOBC	LOOM
http://www.bioassayontology.org/bao#BAO_0000759	BAO	LOOM
http://purl.bioontology.org/ontology/MESH/D004318	MESH	LOOM
http://purl.obolibrary.org/obo/OMIT_0005574	OMIT	LOOM
http://purl.obolibrary.org/obo/CHEBI_50845	PDRO	LOOM
http://purl.obolibrary.org/obo/CHEBI_50845	FIDEO	LOOM
http://purl.obolibrary.org/obo/CHEBI_50845	BERO	LOOM
http://purl.obolibrary.org/obo/CHEBI_50845	BIOMODELS	LOOM
http://purl.obolibrary.org/obo/CHEBI_50845	DRON	LOOM
http://purl.obolibrary.org/obo/CHEBI_50845	NIFSTD	LOOM
http://purl.obolibrary.org/obo/NCIT_C457	BERO	LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#4105	OCHV	LOOM
http://neuromorpho.org/ontologies/experimentconditionH.owl#NMOOt_243	NMOBR	LOOM
http://www.co-ode.org/ontologies/galen#Doxycycline	GALEN	LOOM
http://purl.bioontology.org/ontology/LNC/LP14992-9	LOINC	LOOM
http://purl.bioontology.org/ontology/RXNORM/3640	RXNORM	LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/372478003	SNOMEDCT	LOOM
http://purl.bioontology.org/ontology/NDDF/002748	NDDF	LOOM
http://stirdf.jst.go.jp/id/200907049568038990	IOBC	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D04.615.562.900.200	RH-MESH	LOOM
http://www.semanticweb.org/cjf/ontologies/2022/8/NeuralReprogrammingOntology(NRO)#doxycycline	NRO	LOOM
http://purl.obolibrary.org/obo/ARO_0000069	ARO	LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C457	NCIT	LOOM
http://neuromorpho.org/ontologies/stainingH.owl#NMOOt_243	NMOBR	LOOM
http://purl.obolibrary.org/obo/MESH_D004318	BERO	LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D02.455.426.559.847.562.900.200	RH-MESH	LOOM
http://purl.obolibrary.org/obo/IDOMAL_0000229	IDOMAL	LOOM
http://purl.bioontology.org/ontology/SNMI/C-55020	SNMI	LOOM
https://github.com/sap218/coid/blob/master/coid.owl#COID_00709	COID	LOOM
http://www.phoc.org.cn/pmo/class/PMO_00016919	PMAPP-PMO	LOOM
https://go.drugbank.com/drugs/DB00254	MDM	LOOM
http://purl.bioontology.org/ontology/ATC/A01AB22	ATC	LOOM