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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:pimavanserin
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Accession:CHEBI:133017 term browser browse the term
Definition:A member of the class of ureas in which three of the four hydrogens are replaced by 4-fluorobenzyl, 1-methylpiperidin-4-yl, and 4-(isopropyloxy)benzyl groups. An atypical antipsychotic that is used (in the form of its tartrate salt) for treatment of hallucinations and delusions associated with Parkinson's disease.
Synonyms:exact_synonym: N-[(4-fluorophenyl)methyl]-N-(1-methylpiperidin-4-yl)-N'-{[4-(2-methylpropoxy)phenyl]methyl}urea
 related_synonym: Formula=C25H34FN3O2;   InChI=1S/C25H34FN3O2/c1-19(2)18-31-24-10-6-20(7-11-24)16-27-25(30)29(23-12-14-28(3)15-13-23)17-21-4-8-22(26)9-5-21/h4-11,19,23H,12-18H2,1-3H3,(H,27,30);   InChIKey=RKEWSXXUOLRFBX-UHFFFAOYSA-N;   N-(4-Fluorophenylmethyl)-N-(1-methylpiperidin-4-yl)-N'-(4-(2-methylpropyloxy)phenylmethyl) carbamide;   SMILES=C1=C(C=CC(=C1)CNC(N(C2CCN(CC2)C)CC3=CC=C(C=C3)F)=O)OCC(C)C
 xref: CAS:706779-91-1;   Drug_Central:5142;   PMID:16469866;   PMID:19040345;   PMID:19864614;   PMID:19907417;   PMID:21256805;   PMID:21921840;   PMID:22750845;   PMID:22954754;   PMID:23969614;   PMID:24016069;   PMID:24183563;   PMID:24183566;   PMID:24247322;   PMID:24292660;   PMID:24682754;   PMID:25655720;   PMID:26744739;   PMID:26908168;   PMID:27242287;   PMID:27245248;   PMID:27249096;   PMID:27261226;   PMID:27262680;   PMID:27503570;   Patent:CA2652300;   Reaxys:10386699;   Wikipedia:Pimavanserin
 cyclic_relationship: is_conjugate_base_of CHEBI:133020

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  CHEBI ontology 0
    role 0
      biological role 0
        pharmacological role 0
          inverse agonist 0
            5-hydroxytryptamine 2A receptor inverse agonist 0
              pimavanserin 0
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Term Annotations click to browse term
  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
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbon oxoacid 0
                                    carboxylic acid 0
                                      carboacyl group 0
                                        univalent carboacyl group 0
                                          carbamoyl group 0
                                            carboxamide 0
                                              monocarboxylic acid amide 0
                                                urea 0
                                                  ureas 0
                                                    pimavanserin 0
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