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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:xanomeline
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Accession:CHEBI:10056 term browser browse the term
Definition:A tetrahydropyridine that has formula C14H23N3OS.
Synonyms:exact_synonym: 5-[4-(hexyloxy)-1,2,5-thiadiazol-3-yl]-1-methyl-1,2,3,6-tetrahydropyridine
 related_synonym: Formula=C14H23N3OS;   InChI=1S/C14H23N3OS/c1-3-4-5-6-10-18-14-13(15-19-16-14)12-8-7-9-17(2)11-12/h8H,3-7,9-11H2,1-2H3;   InChIKey=JOLJIIDDOBNFHW-UHFFFAOYSA-N;   LY 246708;   SMILES=CCCCCCOc1nsnc1C1=CCCN(C)C1
 xref: Beilstein:5480228;   CAS:131986-45-3;   Drug_Central:3652;   KEGG:C11767;   KEGG:D06330
 xref_mesh: MESH:C075257
 xref: Patent:EP384288;   Patent:US5043345;   Patent:WO9429303

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xanomeline term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Chrm1 cholinergic receptor, muscarinic 1 increases response to substance
multiple interactions		 ISO
EXP		 CHRM1 gene results in increased susceptibility to xanomeline; CHRM1 results in increased susceptibility to xanomeline
xanomeline binds to and results in increased activity of [CHRM1 protein binds to CHRM4 protein]		 CTD PMID:19111716 PMID:19996296 PMID:21211109 NCBI chr 1:224,869,087...224,885,101
Ensembl chr 1:224,882,439...224,884,205 		JBrowse link
G Chrm4 cholinergic receptor, muscarinic 4 affects binding
increases response to substance
multiple interactions		 ISO
EXP		 xanomeline binds to CHRM4 protein
CHRM4 gene results in increased susceptibility to xanomeline; CHRM4 results in increased susceptibility to xanomeline
[WIN 62577 co-treated with Quinuclidinyl Benzilate] inhibits the reaction [xanomeline binds to CHRM4 protein]
xanomeline binds to and results in increased activity of [CHRM1 protein binds to CHRM4 protein]		 CTD PMID:16709648 PMID:19111716 PMID:19996296 PMID:21211109 NCBI chr 3:80,833,272...80,841,165
Ensembl chr 3:80,833,272...80,841,006 		JBrowse link
G Egr1 early growth response 1 increases expression EXP xanomeline results in increased expression of EGR1 mRNA CTD PMID:11313039 NCBI chr18:27,657,903...27,660,101
Ensembl chr18:27,657,628...27,661,429 		JBrowse link
G Fos Fos proto-oncogene, AP-1 transcription factor subunit increases expression EXP xanomeline results in increased expression of FOS mRNA CTD PMID:11313039 NCBI chr 6:109,300,433...109,303,299
Ensembl chr 6:109,300,433...109,303,299 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19781
    role 19726
      biological role 19726
        pharmacological role 18834
          neurotransmitter agent 16445
            serotonergic drug 3975
              serotonergic agonist 980
                xanomeline 4
Path 2
Term Annotations click to browse term
  CHEBI ontology 19781
    subatomic particle 19779
      composite particle 19779
        hadron 19779
          baryon 19779
            nucleon 19779
              atomic nucleus 19779
                atom 19779
                  main group element atom 19669
                    p-block element atom 19669
                      carbon group element atom 19588
                        carbon atom 19578
                          organic molecular entity 19578
                            organic molecule 19510
                              organic cyclic compound 19337
                                organic heterocyclic compound 18550
                                  organic heteromonocyclic compound 16990
                                    pyridines 8444
                                      tetrahydropyridine 422
                                        xanomeline 4
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