The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016
Preferred Name

iloperidone
Synonyms

Fanapta

Fanapt

1-[4-[3-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1- piperidinyl]propoxy]-3-methoxyphenyl]ethanone

1-(4-{3-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]propoxy}-3-methoxyphenyl)ethanone

iloperidonum

C24H27FN2O4

iloperidone

Zomaril

4'-(3-(4-(6-fluoro-1,2-benzisoxazol-3-yl)piperidino)propoxy)-3'-methoxyacetophenone

1-(4-{3-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]propoxy}-3-methoxyphenyl)ethan-1-one

iloperidona

ID

http://purl.obolibrary.org/obo/CHEBI_65173

AHFScode

28:16.08.04

ATCCode

N05AX14

binds

http://purl.obolibrary.org/obo/dinto_2804

http://purl.obolibrary.org/obo/dinto_0392

http://purl.obolibrary.org/obo/dinto_3340

http://purl.obolibrary.org/obo/dinto_3203

http://purl.obolibrary.org/obo/dinto_4010

http://purl.obolibrary.org/obo/dinto_1581

http://purl.obolibrary.org/obo/dinto_0656

http://purl.obolibrary.org/obo/dinto_0909

http://purl.obolibrary.org/obo/dinto_1071

http://purl.obolibrary.org/obo/dinto_1166

http://purl.obolibrary.org/obo/dinto_0234

http://purl.obolibrary.org/obo/dinto_2651

http://purl.obolibrary.org/obo/dinto_2990

http://purl.obolibrary.org/obo/dinto_2993

http://purl.obolibrary.org/obo/dinto_0293

http://purl.obolibrary.org/obo/dinto_0901

http://purl.obolibrary.org/obo/dinto_1956

blocks

http://purl.obolibrary.org/obo/dinto_3340

http://purl.obolibrary.org/obo/dinto_2804

http://purl.obolibrary.org/obo/dinto_3203

http://purl.obolibrary.org/obo/dinto_4010

http://purl.obolibrary.org/obo/dinto_1581

http://purl.obolibrary.org/obo/dinto_0656

http://purl.obolibrary.org/obo/dinto_0909

http://purl.obolibrary.org/obo/dinto_1071

http://purl.obolibrary.org/obo/dinto_1166

http://purl.obolibrary.org/obo/dinto_0392

http://purl.obolibrary.org/obo/dinto_0234

CASRN

133454-47-4

DBBrand

fiapta

fanapt

zomaril

DBSynonym

hp 873

Definition

Iloperidone is an atypical antipsychotic for the treatment of schizophrenia symptoms. Hoechst Marion Roussel Inc. made initial inquiries into the drug; however, in May 1996, they discontinued research, and in June 1997 gave research rights to Titan Pharmaceuticals. Titan then handed over worldwide development, manufacturing and marketing rights to Novartis in August 1998. On June 9, 2004, Titan Pharmaceuticals announced that the Phase III development rights have been acquired by Vanda Pharmaceuticals. FDA approved on May 9, 2009.

A member of the class of piperidines that is the 4-acetyl-2-methoxyphenyl ether of 3-(piperidin-1-yl)propan-1-ol which is substituted at position 4 of the piperidine ring by a 6-fluoro-1,2-benzoxazol-3-yl group. A member of the group of second generation antipsychotics (also known as an atypical antipsychotics), it is used for the treatment of schizophrenia.

has pharmacological target

http://purl.obolibrary.org/obo/dinto_2804

http://purl.obolibrary.org/obo/dinto_0392

has role

http://purl.obolibrary.org/obo/CHEBI_48561

http://purl.obolibrary.org/obo/CHEBI_48279

http://purl.obolibrary.org/obo/CHEBI_65191

InChI

InChI=1S/C24H27FN2O4/c1-16(28)18-4-7-21(23(14-18)29-2)30-13-3-10-27-11-8-17(9-12-27)24-20-6-5-19(25)15-22(20)31-26-24/h4-7,14-15,17H,3,8-13H2,1-2H3

InChIKey

InChIKey=XMXHEBAFVSFQEX-UHFFFAOYSA-N

is metabolised by

http://purl.obolibrary.org/obo/dinto_2651

http://purl.obolibrary.org/obo/dinto_2990

http://purl.obolibrary.org/obo/dinto_2993

http://purl.obolibrary.org/obo/dinto_0293

http://purl.obolibrary.org/obo/dinto_0901

http://purl.obolibrary.org/obo/dinto_1956

is substrate of

http://purl.obolibrary.org/obo/dinto_2651

http://purl.obolibrary.org/obo/dinto_2990

http://purl.obolibrary.org/obo/dinto_2993

http://purl.obolibrary.org/obo/dinto_0293

http://purl.obolibrary.org/obo/dinto_0901

http://purl.obolibrary.org/obo/dinto_1956

label

iloperidone

may interact with

http://purl.obolibrary.org/obo/CHEBI_7936

http://purl.obolibrary.org/obo/CHEBI_156095

http://purl.obolibrary.org/obo/CHEBI_51364

http://purl.obolibrary.org/obo/CHEBI_681850

http://purl.obolibrary.org/obo/CHEBI_10119

http://purl.obolibrary.org/obo/CHEBI_3732

http://purl.obolibrary.org/obo/CHEBI_27958

http://purl.obolibrary.org/obo/dinto_DB01026

http://purl.obolibrary.org/obo/CHEBI_195280

http://purl.obolibrary.org/obo/CHEBI_5118

modulates

http://purl.obolibrary.org/obo/dinto_3340

http://purl.obolibrary.org/obo/dinto_2804

http://purl.obolibrary.org/obo/dinto_3203

http://purl.obolibrary.org/obo/dinto_4010

http://purl.obolibrary.org/obo/dinto_1581

http://purl.obolibrary.org/obo/dinto_0656

http://purl.obolibrary.org/obo/dinto_0909

http://purl.obolibrary.org/obo/dinto_1071

http://purl.obolibrary.org/obo/dinto_1166

http://purl.obolibrary.org/obo/dinto_0392

http://purl.obolibrary.org/obo/dinto_0234

prefixIRI

obo2:CHEBI_65173

prefLabel

iloperidone

SMILES

COC1=C(OCCCN2CCC(CC2)C2=NOC3=C2C=CC(F)=C3)C=CC(=C1)C(C)=O

COc1cc(ccc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12)C(C)=O

Synonym

Fanapta

Fanapt

1-[4-[3-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1- piperidinyl]propoxy]-3-methoxyphenyl]ethanone

1-(4-{3-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]propoxy}-3-methoxyphenyl)ethanone

iloperidonum

C24H27FN2O4

iloperidone

Zomaril

4'-(3-(4-(6-fluoro-1,2-benzisoxazol-3-yl)piperidino)propoxy)-3'-methoxyacetophenone

1-(4-{3-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]propoxy}-3-methoxyphenyl)ethan-1-one

iloperidona

xref

CiteXplore:21600386

ChemSpider:64459

CiteXplore:22453868

CiteXplore:21289324

Drugs.com:http://www.drugs.com/fanapt.html

Wikipedia:Iloperidone

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

CiteXplore:21474903

BindingDB:50034043

National Drug Code Directory:43068-110-02

CiteXplore:22617084

RxList:http://www.rxlist.com/fanapt-drug.htm

CiteXplore:22161738

CiteXplore:22217439

Reaxys:7233425

CASRN:133454-47-4

SUBMITTER:133454-47-4

PubChem Compound:71360

PharmGKB:PA161199368

SUBMITTER:D02666

CiteXplore:22465688

ChEMBL:113949

PubChem Substance:12014542

subClassOf

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

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Mapping To Ontology Source
http://purl.obolibrary.org/obo/CHEBI_65173 OBA SAME_URI
http://purl.obolibrary.org/obo/CHEBI_65173 DRON SAME_URI
http://purl.obolibrary.org/obo/CHEBI_65173 PDRO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_65173 GO-PLUS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_65173 BERO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_65173 DDSS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_65173 CHEBI SAME_URI
http://purl.obolibrary.org/obo/CHEBI_65173 ECTO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_65173 OBA LOOM
http://purl.bioontology.org/ontology/MESH/C081732 MESH LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#C081732 RH-MESH LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000178412 NDFRT LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C83784 NCIT LOOM
http://purl.bioontology.org/ontology/LNC/MTHU035823 LOINC LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/442849001 SNOMEDCT LOOM
https://go.drugbank.com/drugs/DB04946 MDM LOOM
http://purl.bioontology.org/ontology/ATC/N05AX14 ATC LOOM
http://purl.bioontology.org/ontology/RXNORM/73178 RXNORM LOOM
http://www.drugbank.ca/drugs/DB04946 FTC LOOM
http://purl.bioontology.org/ontology/VANDF/4028716 VANDF LOOM
http://www.case.edu/EpilepsyOntology.owl#Iloperidone EPSO LOOM
http://www.case.edu/EpSO.owl#Iloperidone MEPO LOOM
http://www.phoc.org.cn/pmo/class/PMO_00026515 PMAPP-PMO LOOM
http://purl.obolibrary.org/obo/CHEBI_65173 DRON LOOM
http://purl.obolibrary.org/obo/CHEBI_65173 PDRO LOOM
http://purl.obolibrary.org/obo/CHEBI_65173 GO-PLUS LOOM
http://purl.obolibrary.org/obo/CHEBI_65173 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_65173 DDSS LOOM
http://purl.obolibrary.org/obo/CHEBI_65173 CHEBI LOOM
http://purl.obolibrary.org/obo/CHEBI_65173 ECTO LOOM
http://purl.bioontology.org/ontology/NDDF/013338 NDDF LOOM
http://purl.bioontology.org/ontology/LNC/LP100039-9 LOINC LOOM
http://purl.obolibrary.org/obo/NCIT_C83784 BERO LOOM