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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:doxylamine
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Accession:CHEBI:51380 term browser browse the term
Definition:A tertiary amine that has formula C17H22N2O.
Synonyms:exact_synonym: N,N-dimethyl-2-(1-phenyl-1-pyridin-2-ylethoxy)ethanamine
 related_synonym: 2-(alpha-(2-(Dimethylamino)ethoxy)-alpha-methylbenzyl)pyridine;   2-Dimethylaminoethoxyphenylmethyl-2-picoline;   Dossilamina;   Doxilminio;   Formula=C17H22N2O;   InChI=1S/C17H22N2O/c1-17(20-14-13-19(2)3,15-9-5-4-6-10-15)16-11-7-8-12-18-16/h4-12H,13-14H2,1-3H3;   InChIKey=HCFDWZZGGLSKEP-UHFFFAOYSA-N;   N,N-Dimethyl-2-(1-phenyl-1-(2-pyridinyl)ethoxy)ethanamine;   Phenyl-2-pyridylmethyl-beta-N,N-dimethylaminoethyl ether;   SMILES=CN(C)CCOC(C)(c1ccccc1)c1ccccn1;   doxilamina;   doxylaminum
 xref: Beilstein:230379;   CAS:469-21-6;   DrugBank:DB00366;   Drug_Central:962;   KEGG:D07878;   LINCS:LSM-1563
 xref_mesh: MESH:D004319
 xref: Wikipedia:Doxylamine


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doxylamine term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Abcb4 ATP binding cassette subfamily B member 4 decreases activity ISO Doxylamine results in decreased activity of ABCB4 protein CTD PMID:28437613 NCBI chr 4:25,150,998...25,209,489
Ensembl chr 4:25,151,953...25,209,202
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G Nr1i3 nuclear receptor subfamily 1, group I, member 3 multiple interactions ISO Doxylamine binds to and results in increased activity of NR1I3 protein alternative form CTD PMID:20869355 NCBI chr13:83,632,940...83,638,193
Ensembl chr13:83,632,899...83,637,906
JBrowse link

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19812
    role 19761
      biological role 19761
        pharmacological role 18842
          antagonist 16278
            histamine antagonist 4615
              doxylamine 2
Path 2
Term Annotations click to browse term
  CHEBI ontology 19812
    subatomic particle 19811
      composite particle 19811
        hadron 19811
          baryon 19811
            nucleon 19811
              atomic nucleus 19811
                atom 19811
                  main group element atom 19708
                    main group molecular entity 19708
                      s-block molecular entity 19493
                        hydrogen molecular entity 19488
                          hydrides 18845
                            inorganic hydride 17691
                              pnictogen hydride 17672
                                nitrogen hydride 17545
                                  azane 17279
                                    ammonia 17278
                                      organic amino compound 17278
                                        tertiary amino compound 8677
                                          tertiary amine 619
                                            doxylamine 2
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