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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 1:214,996,180...215,012,136
Ensembl chr 1:214,995,872...215,020,602 		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 3:98,349,080...98,356,821
Ensembl chr 3:98,348,650...98,358,771 		JBrowse link
G Egr1 early growth response 1 increases expression EXP xanomeline results in increased expression of EGR1 mRNA CTD PMID:11313039 NCBI chr18:26,737,078...26,740,877
Ensembl chr18:26,736,838...26,740,843 		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 6:110,852,188...110,855,054
Ensembl chr 6:110,852,190...110,855,598 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 20862
    role 20820
      biological role 20818
        pharmacological role 19911
          neurotransmitter agent 16947
            serotonergic drug 4420
              serotonergic agonist 1044
                xanomeline 4
Path 2
Term Annotations click to browse term
  CHEBI ontology 20862
    subatomic particle 20860
      composite particle 20860
        hadron 20860
          baryon 20860
            nucleon 20860
              atomic nucleus 20860
                atom 20860
                  main group element atom 20781
                    p-block element atom 20781
                      carbon group element atom 20715
                        carbon atom 20710
                          organic molecular entity 20710
                            organic molecule 20654
                              organic cyclic compound 20404
                                organic heterocyclic compound 19388
                                  organic heteromonocyclic compound 18212
                                    pyridines 12234
                                      tetrahydropyridine 463
                                        xanomeline 4
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