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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
Term:iloperidone
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Accession:CHEBI:65173 term browser browse the term
Definition: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.
Synonyms:exact_synonym: 1-(4-{3-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]propoxy}-3-methoxyphenyl)ethanone
 related_synonym: 1-[4-[3-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1- piperidinyl]propoxy]-3-methoxyphenyl]ethanone;   4'-(3-(4-(6-fluoro-1,2-benzisoxazol-3-yl)piperidino)propoxy)-3'-methoxyacetophenone;   Fanapt;   Fanapta;   Formula=C24H27FN2O4;   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=XMXHEBAFVSFQEX-UHFFFAOYSA-N;   SMILES=COc1cc(ccc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12)C(C)=O;   Zomaril;   iloperidona;   iloperidonum
 xref: CAS:133454-47-4;   Drug_Central:3294;   KEGG:D02666;   LINCS:LSM-5598
 xref_mesh: MESH:C081732
 xref: PMID:21289324;   PMID:21474903;   PMID:21600386;   PMID:22161738;   PMID:22217439;   PMID:22453868;   PMID:22465688;   PMID:22617084;   Reaxys:7233425;   Wikipedia:Iloperidone


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  CHEBI ontology 0
    role 0
      biological role 0
        pharmacological role 0
          antagonist 0
            dopaminergic antagonist 0
              iloperidone 0
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            organic molecule 0
                              organic cyclic compound 0
                                organic heterocyclic compound 0
                                  organic heteropolycyclic compound 0
                                    organic heterobicyclic compound 0
                                      benzoxazole 0
                                        benzisoxazole 0
                                          1,2-benzoxazoles 0
                                            iloperidone 0
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