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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:parecoxib
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Accession:CHEBI:73038 term browser browse the term
Definition:An N-acylsulfonamide resulting from the formal condensation of valdecoxib with propionic acid. It is a prodrug for valdecoxib.
Synonyms:related_synonym: N-((p-(5-methyl-3-phenyl-4-isoxazolyl)phenyl)sulfonyl)propionamide;   N-{[4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)phenyl]sulfonyl}propanamide;   SC-69124;   parecoxibum
 xref: CAS:198470-84-7
 xref_mesh: MESH:C409945
 xref: Reaxys:8640266;   drugcentral:2063;   kegg.drug:D02709;   lincs.smallmolecule:LSM-5316;   pdb-ccd:PXB;   wikipedia.en:Parecoxib
 chemrof_formula: C19H18N2O4S
 chemrof_smiles: CCC(=O)NS(=O)(=O)c1ccc(-c2c(-c3ccccc3)noc2C)cc1
 chemrof_inchi: InChI=1S/C19H18N2O4S/c1-3-17(22)21-26(23,24)16-11-9-14(10-12-16)18-13(2)25-20-19(18)15-7-5-4-6-8-15/h4-12H,3H2,1-2H3,(H,21,22)
 chemrof_inchikey: TZRHLKRLEZJVIJ-UHFFFAOYSA-N
 cyclic_relationship: has_functional_parent CHEBI:63634


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parecoxib term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Cdh1 cadherin 1 increases expression ISO parecoxib results in increased expression of CDH1 protein CTD PMID:35917206 NCBI chr19:51,402,178...51,471,572
Ensembl chr19:51,402,034...51,471,565 		JBrowse link
G Cnr1 cannabinoid receptor 1 increases response to substance ISO CNR1 protein results in increased susceptibility to parecoxib CTD PMID:23371449 NCBI chr 5:53,204,867...53,230,396
Ensembl chr 5:53,204,260...53,239,252 		JBrowse link
G Ctnnb1 catenin beta 1 decreases expression ISO parecoxib results in decreased expression of CTNNB1 protein CTD PMID:35917206 NCBI chr 8:129,517,576...129,544,661
Ensembl chr 8:129,517,545...129,544,662 		JBrowse link
G Gsk3b glycogen synthase kinase 3 beta decreases expression
increases expression 		ISO parecoxib results in decreased expression of GSK3B protein modified form
parecoxib results in increased expression of GSK3B protein 		CTD PMID:35917206 NCBI chr11:76,004,502...76,154,665
Ensembl chr11:76,009,507...76,153,249 		JBrowse link
G Macc1 MET transcriptional regulator MACC1 decreases expression ISO parecoxib results in decreased expression of MACC1 protein CTD PMID:35917206 NCBI chr 6:146,495,544...146,574,254
Ensembl chr 6:146,495,861...146,574,260 		JBrowse link
G Mapk1 mitogen activated protein kinase 1 decreases phosphorylation ISO parecoxib results in decreased phosphorylation of MAPK1 protein CTD PMID:35917206 NCBI chr11:97,462,025...97,529,193
Ensembl chr11:97,462,025...97,527,825 		JBrowse link
G Mapk3 mitogen activated protein kinase 3 decreases phosphorylation ISO parecoxib results in decreased phosphorylation of MAPK3 protein CTD PMID:35917206 NCBI chr 1:190,797,189...190,803,411
Ensembl chr 1:190,797,185...190,803,411 		JBrowse link
G Mapk8 mitogen-activated protein kinase 8 increases phosphorylation ISO parecoxib results in increased phosphorylation of MAPK8 protein CTD PMID:35917206 NCBI chr16:8,645,171...8,728,225
Ensembl chr16:8,645,198...8,728,427 		JBrowse link
G Mapk9 mitogen-activated protein kinase 9 increases phosphorylation ISO parecoxib results in increased phosphorylation of MAPK9 protein CTD PMID:35917206 NCBI chr10:34,670,750...34,711,972
Ensembl chr10:34,670,756...34,712,228 		JBrowse link
G Met MET proto-oncogene, receptor tyrosine kinase decreases expression ISO parecoxib results in decreased expression of MET protein CTD PMID:35917206 NCBI chr 4:46,756,823...46,864,041
Ensembl chr 4:46,756,506...46,870,821 		JBrowse link
G Vim vimentin decreases expression ISO parecoxib results in decreased expression of VIM protein CTD PMID:35917206 NCBI chr17:81,577,261...81,585,746
Ensembl chr17:81,568,272...81,585,746 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 20874
    role 20844
      application 20572
        pro-agent 8265
          prodrug 7985
            parecoxib 11
Path 2
Term Annotations click to browse term
  CHEBI ontology 20874
    subatomic particle 20883
      composite particle 20883
        hadron 20872
          baryon 20883
            nucleon 20872
              atomic nucleus 20883
                atom 20872
                  main group element atom 20796
                    p-block element atom 20796
                      carbon group element atom 20712
                        carbon atom 20706
                          organic molecular entity 20706
                            organic molecule 20499
                              organic cyclic compound 20390
                                organic heterocyclic compound 19381
                                  heteroarene 17357
                                    monocyclic heteroarene 15176
                                      azole 14629
                                        oxazole 3741
                                          isoxazoles 3137
                                            parecoxib 11
paths to the root