The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016
Preferred Name

adapalene
Synonyms

6-(3-(1-Adamantyl)-4-methoxyphenyl)-2-naphthoic acid

adapaleno

Adaferin

6-[3-(adamantan-1-yl)-4-methoxyphenyl]naphthalene-2-carboxylic acid

C28H28O3

6-(3-adamantan-1-yl-4-methoxyphenyl)naphthalene-2-carboxylic acid

Differine

adapalene

adapalenum

ID

http://purl.obolibrary.org/obo/CHEBI_31174

activates

http://purl.obolibrary.org/obo/dinto_1682

http://purl.obolibrary.org/obo/dinto_3327

http://purl.obolibrary.org/obo/dinto_1077

http://purl.obolibrary.org/obo/dinto_2703

http://purl.obolibrary.org/obo/dinto_3482

AHFScode

84:92.00

ATCCode

D10AD03

binds

http://purl.obolibrary.org/obo/dinto_0736

http://purl.obolibrary.org/obo/dinto_1682

http://purl.obolibrary.org/obo/dinto_1077

http://purl.obolibrary.org/obo/dinto_2703

http://purl.obolibrary.org/obo/dinto_3482

http://purl.obolibrary.org/obo/dinto_3327

CASRN

106685-40-9

DBBrand

adaferin

differin

DBname

adapalene

DBSynonym

adapaleno [inn-spanish]

adapalenum [inn-latin]

Definition

An adamantane that has formula C28H28O3.

has effect

http://purl.obolibrary.org/obo/OAE_0000081

http://purl.obolibrary.org/obo/OAE_0000905

http://purl.obolibrary.org/obo/OAE_0000376

http://purl.obolibrary.org/obo/OAE_0000561

http://purl.obolibrary.org/obo/OAE_0000373

http://purl.obolibrary.org/obo/OAE_0000210

http://purl.obolibrary.org/obo/OAE_0000937

http://purl.obolibrary.org/obo/OAE_0000687

http://purl.obolibrary.org/obo/OAE_0000086

http://purl.obolibrary.org/obo/OAE_0000645

http://purl.obolibrary.org/obo/OAE_0000894

http://purl.obolibrary.org/obo/OAE_0001276

http://purl.obolibrary.org/obo/OAE_0000306

http://purl.obolibrary.org/obo/OAE_0000362

http://purl.obolibrary.org/obo/OAE_0000470

http://purl.obolibrary.org/obo/OAE_0000374

http://purl.obolibrary.org/obo/OAE_0000330

has pharmacological target

http://purl.obolibrary.org/obo/dinto_1682

http://purl.obolibrary.org/obo/dinto_1077

http://purl.obolibrary.org/obo/dinto_2703

http://purl.obolibrary.org/obo/dinto_3482

has role

http://purl.obolibrary.org/obo/CHEBI_35475

http://purl.obolibrary.org/obo/CHEBI_50177

InChI

InChI=1S/C28H28O3/c1-31-26-7-6-23(21-2-3-22-12-24(27(29)30)5-4-20(22)11-21)13-25(26)28-14-17-8-18(15-28)10-19(9-17)16-28/h2-7,11-13,17-19H,8-10,14-16H2,1H3,(H,29,30)

InChIKey

InChIKey=LZCDAPDGXCYOEH-UHFFFAOYSA-N

label

adapalene

modulates

http://purl.obolibrary.org/obo/dinto_1682

http://purl.obolibrary.org/obo/dinto_3327

http://purl.obolibrary.org/obo/dinto_1077

http://purl.obolibrary.org/obo/dinto_2703

http://purl.obolibrary.org/obo/dinto_3482

prefixIRI

obo2:CHEBI_31174

prefLabel

adapalene

related with

http://purl.obolibrary.org/obo/dinto_0736

SMILES

COc1ccc(cc1C12CC3CC(CC(C3)C1)C2)-c1ccc2cc(ccc2c1)C(O)=O

COC1=C(C=C(C=C1)C1=CC2=C(C=C1)C=C(C=C2)C(O)=O)C12CC3CC(CC(C3)C1)C2

Synonym

6-(3-(1-Adamantyl)-4-methoxyphenyl)-2-naphthoic acid

adapaleno

Adaferin

6-[3-(adamantan-1-yl)-4-methoxyphenyl]naphthalene-2-carboxylic acid

C28H28O3

6-(3-adamantan-1-yl-4-methoxyphenyl)naphthalene-2-carboxylic acid

Differine

adapalene

adapalenum

xref

RxList:http://www.rxlist.com/cgi/generic3/adapalene.htm

CASRN:106685-40-9

Drugs.com:http://www.drugs.com/cdi/adapalene-cream.html

ChemSpider:54244

DrugBank:DB00210

ChEBI:31174

PDRhealth:http://www.pdrhealth.com/drug_info/rxdrugprofiles/drugs/dif1134.shtml

Drugs Product Database (DPD):2231592

Patent:US4717720

PubChem Compound:60164

Wikipedia:Adapalene

Wikipedia:http://en.wikipedia.org/wiki/Adapalene

National Drug Code Directory:0299-5910-45

Patent:EP199636

ChEMBL:344450

PubChem Substance:46505019

KEGG DRUG:D01112

PharmGKB:PA448047

subClassOf

http://purl.obolibrary.org/obo/dinto_000055

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Delete Mapping To Ontology Source
http://purl.obolibrary.org/obo/CHEBI_31174 DRON SAME_URI
http://purl.obolibrary.org/obo/CHEBI_31174 PDRO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_31174 BERO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_31174 DDSS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_31174 BIOMODELS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_31174 CHEBI SAME_URI
http://purl.obolibrary.org/obo/CHEBI_31174 NIFSTD SAME_URI
http://purl.obolibrary.org/obo/CHEBI_31174 DRON SAME_URI
http://purl.bioontology.org/ontology/SNOMEDCT/386934008 SNOMEDCT LOOM
http://purl.jp/bio/4/id/200906076199760982 IOBC LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0165631 OCHV LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000148452 NDFRT LOOM
http://purl.bioontology.org/ontology/ATC/D10AD03 ATC LOOM
http://purl.obolibrary.org/obo/OMIT_0001331 OMIT LOOM
http://stirdf.jst.go.jp/id/200907009404272630 IOBC LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#C063610 RH-MESH LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C28989 NCIT LOOM
http://www.drugbank.ca/drugs/DB00210 FTC LOOM
http://purl.bioontology.org/ontology/VANDF/4020981 VANDF LOOM
http://www.co-ode.org/ontologies/galen#Adapalene GALEN LOOM
http://purl.bioontology.org/ontology/NDDF/005905 NDDF LOOM
http://purl.bioontology.org/ontology/RXNORM/60223 RXNORM LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#18073 OCHV LOOM
http://www.phoc.org.cn/pmo/class/PMO_00016937 PMAPP-PMO LOOM
http://purl.obolibrary.org/obo/NCIT_C28989 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_31174 DRON LOOM
http://purl.obolibrary.org/obo/CHEBI_31174 PDRO LOOM
http://purl.obolibrary.org/obo/CHEBI_31174 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_31174 DDSS LOOM
http://purl.obolibrary.org/obo/CHEBI_31174 BIOMODELS LOOM
http://purl.obolibrary.org/obo/CHEBI_31174 CHEBI LOOM
http://purl.obolibrary.org/obo/CHEBI_31174 NIFSTD LOOM
http://purl.obolibrary.org/obo/CHEBI_31174 DRON LOOM
http://purl.obolibrary.org/obo/MESH_D000068816 BERO LOOM
https://go.drugbank.com/drugs/DB00210 MDM LOOM
http://purl.bioontology.org/ontology/RCD/m6D.. RCD LOOM
http://purl.bioontology.org/ontology/MESH/D000068816 MESH LOOM