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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:elvitegravir
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Accession:CHEBI:72289 term browser browse the term
Definition:A quinolinemonocarboxylic acid that is 7-methoxy-4-oxo-1,4-dihydroquinoline-3-carboxylic acid substited at position 1 by a 1-hydroxy-3-methylbutan-2-yl group and at position 6 by a 3-chloro-2-fluorobenzyl group (the S-enantiomer). It is used in combination therapy for the treatment of HIV-1 infection.
Synonyms:exact_synonym: 6-(3-chloro-2-fluorobenzyl)-1-[(2S)-1-hydroxy-3-methylbutan-2-yl]-7-methoxy-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
 related_synonym: Formula=C23H23ClFNO5;   GS-9137;   InChI=1S/C23H23ClFNO5/c1-12(2)19(11-27)26-10-16(23(29)30)22(28)15-8-14(20(31-3)9-18(15)26)7-13-5-4-6-17(24)21(13)25/h4-6,8-10,12,19,27H,7,11H2,1-3H3,(H,29,30)/t19-/m1/s1;   InChIKey=JUZYLCPPVHEVSV-LJQANCHMSA-N;   SMILES=COc1cc2n(cc(C(O)=O)c(=O)c2cc1Cc1cccc(Cl)c1F)[C@H](CO)C(C)C;   elvitegravirum
 xref: CAS:697761-98-1;   Drug_Central:4300;   KEGG:D06677;   LINCS:LSM-5647
 xref_mesh: MESH:C509700
 xref: PMID:20040702;   PMID:21044030;   PMID:21505303;   PMID:22015077;   PMID:22197635;   PMID:22256860;   PMID:22321026;   PMID:22347806;   PMID:22571404;   PMID:22766666;   PMID:22789987;   PMID:22886031;   PMID:22992351;   PMID:23028968;   PMID:23114768;   PMID:23123342;   PMID:23136357;   PMID:23231029;   PMID:23253887;   PMID:23337366;   PMID:23341902;   PMID:23372110;   Patent:WO2009089263;   Patent:WO2010137032;   Patent:WO2011004389;   Reaxys:10609264;   Wikipedia:Elvitegravir


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elvitegravir term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Aldh1a2 aldehyde dehydrogenase 1 family, member A2 decreases expression ISO elvitegravir results in decreased expression of ALDH1A2 mRNA CTD PMID:34515794 NCBI chr 8:71,877,850...71,957,107
Ensembl chr 8:71,877,850...71,957,107 		JBrowse link
G Fgf8 fibroblast growth factor 8 increases expression ISO elvitegravir results in increased expression of FGF8 mRNA CTD PMID:34515794 NCBI chr 1:244,584,477...244,590,578
Ensembl chr 1:244,584,652...244,590,359 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19808
    chemical entity 19806
      molecular entity 19806
        polyatomic entity 19764
          heteroatomic molecular entity 19720
            halide 18630
              organohalogen compound 18502
                organofluorine compound 14953
                  elvitegravir 2
                    Genvoya 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19808
    subatomic particle 19806
      composite particle 19806
        hadron 19806
          baryon 19806
            nucleon 19806
              atomic nucleus 19806
                atom 19806
                  main group element atom 19756
                    p-block element atom 19756
                      carbon group element atom 19705
                        carbon atom 19702
                          organic molecular entity 19702
                            heteroorganic entity 19460
                              organochalcogen compound 19224
                                organooxygen compound 19141
                                  carbon oxoacid 18612
                                    carboxylic acid 18609
                                      aromatic carboxylic acid 12598
                                        quinolinemonocarboxylic acid 107
                                          elvitegravir 2
                                            Genvoya 0
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