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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:palonosetron
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Accession:CHEBI:85161 term browser browse the term
Definition:An organic heterotricyclic compound that is an antiemetic used (as its hydrochloride salt) in combination with netupitant (under the trade name Akynzeo) to treat nausea and vomiting in patients undergoing cancer chemotherapy.
Synonyms:exact_synonym: (3aS)-2-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-2,3,3a,4,5,6-hexahydro-1H-benzo[de]isoquinolin-1-one
 related_synonym: 2-(1-Azabicyclo(2.2.2)oct-3-yl)-2,3,3a,4,5,6-hexahydro-1H-benz(de)isoquinolin-1-one;   Formula=C19H24N2O;   InChI=1S/C19H24N2O/c22-19-16-6-2-4-14-3-1-5-15(18(14)16)11-21(19)17-12-20-9-7-13(17)8-10-20/h2,4,6,13,15,17H,1,3,5,7-12H2/t15-,17-/m1/s1;   InChIKey=CPZBLNMUGSZIPR-NVXWUHKLSA-N;   SMILES=O=C1N(C[C@H]2CCCc3cccc1c23)[C@@H]1CN2CCC1CC2;   palonosetronum
 xref: CAS:135729-61-2;   DrugBank:DB00377;   Drug_Central:2046;   HMDB:HMDB0014521;   KEGG:D07175;   LINCS:LSM-5266
 xref_mesh: MESH:C083418
 xref: PMID:23653153;   PMID:24129597;   PMID:24154700;   PMID:24280811;   PMID:24590374;   PMID:24604014;   PMID:24935579;   PMID:24947121;   PMID:25037960;   PMID:25063271;   PMID:25179689;   PMID:25360998;   PMID:25435944;   PMID:25533447;   Wikipedia:Palonosetron
 cyclic_relationship: is_conjugate_base_of CHEBI:85163


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palonosetron term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Kcnh2 potassium voltage-gated channel subfamily H member 2 decreases activity ISO palonosetron results in decreased activity of KCNH2 protein CTD PMID:28551711 NCBI chr 4:10,826,834...10,859,009
Ensembl chr 4:10,826,928...10,859,008 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19811
    role 19818
      application 19630
        pharmaceutical 19503
          drug 19471
            antiemetic 5354
              palonosetron 1
Path 2
Term Annotations click to browse term
  CHEBI ontology 19811
    subatomic particle 19809
      composite particle 19809
        hadron 19840
          baryon 19809
            nucleon 19809
              atomic nucleus 19809
                atom 19809
                  main group element atom 19759
                    p-block element atom 19759
                      carbon group element atom 19708
                        carbon atom 19734
                          organic molecular entity 19705
                            heteroorganic entity 19459
                              organochalcogen compound 19222
                                organooxygen compound 19137
                                  carbon oxoacid 18597
                                    carboxylic acid 18594
                                      carboacyl group 17675
                                        univalent carboacyl group 17675
                                          carbamoyl group 17524
                                            carboxamide 17547
                                              lactam 8380
                                                delta-lactam 1204
                                                  palonosetron 1
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