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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:eletriptan
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Accession:CHEBI:50922 term browser browse the term
Definition:An N-alkylpyrrolidine, that is N-methylpyrrolidine in which the pro-R hydrogen at position 2 is replaced by a {5-[2-(phenylsulfonyl)ethyl]-1H-indol-3-yl}methyl group.
Synonyms:exact_synonym: 3-{[(2R)-1-methylpyrrolidin-2-yl]methyl}-5-[2-(phenylsulfonyl)ethyl]-1H-indole
 related_synonym: Formula=C22H26N2O2S;   InChI=1S/C22H26N2O2S/c1-24-12-5-6-19(24)15-18-16-23-22-10-9-17(14-21(18)22)11-13-27(25,26)20-7-3-2-4-8-20/h2-4,7-10,14,16,19,23H,5-6,11-13,15H2,1H3/t19-/m1/s1;   InChIKey=PWVXXGRKLHYWKM-LJQANCHMSA-N;   SMILES=C1=CC=CC=C1S(CCC2=CC3=C(C=C2)NC=C3C[C@@H]4N(CCC4)C)(=O)=O;   eletriptanum
 xref: CAS:143322-58-1;   DrugBank:DB00216;   Drug_Central:995;   KEGG:D07887
 xref_mesh: MESH:C115647
 xref: Patent:US5545644;   Patent:US6110940;   Patent:WO9206973;   Reaxys:8441596;   Wikipedia:Eletriptan
 cyclic_relationship: is_conjugate_base_of CHEBI:61177



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eletriptan term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Calca calcitonin-related polypeptide alpha multiple interactions
decreases expression
EXP GR 127935 inhibits the reaction [eletriptan results in decreased expression of CALCA mRNA]; isamoltane inhibits the reaction [eletriptan results in decreased expression of CALCA mRNA] CTD PMID:14715155 NCBI chr 1:168,878,212...168,883,176
Ensembl chr 1:168,878,214...168,883,105
JBrowse link
G Htr1b 5-hydroxytryptamine receptor 1B multiple interactions EXP eletriptan binds to and results in increased activity of HTR1B protein CTD PMID:11301495 NCBI chr 8:82,513,572...82,534,892
Ensembl chr 8:82,517,360...82,534,549
JBrowse link
G Htr1d 5-hydroxytryptamine receptor 1D multiple interactions EXP eletriptan binds to and results in increased activity of HTR1D protein CTD PMID:11301495 NCBI chr 5:148,655,979...148,676,534
Ensembl chr 5:148,674,495...148,675,619
JBrowse link
G Kcnh2 potassium voltage-gated channel subfamily H member 2 decreases activity ISO eletriptan 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

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Term Annotations click to browse term
  CHEBI ontology 19795
    role 19746
      application 19492
        anti-inflammatory agent 15837
          anti-inflammatory drug 13633
            non-steroidal anti-inflammatory drug 12718
              eletriptan 4
Path 2
Term Annotations click to browse term
  CHEBI ontology 19795
    subatomic particle 19794
      composite particle 19794
        hadron 19794
          baryon 19794
            nucleon 19794
              atomic nucleus 19794
                atom 19794
                  main group element atom 19693
                    main group molecular entity 19693
                      s-block molecular entity 19474
                        hydrogen molecular entity 19466
                          hydrides 18830
                            inorganic hydride 17688
                              pnictogen hydride 17668
                                nitrogen hydride 17540
                                  azane 17273
                                    ammonia 17272
                                      organic amino compound 17272
                                        tertiary amino compound 8695
                                          N-alkylpyrrolidine 1183
                                            eletriptan 4
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