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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:Belnacasan
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Accession:CHEBI:188567 term browser browse the term
Synonyms:exact_synonym: (2S)-1-[(2S)-2-[(4-amino-3-chlorobenzoyl)amino]-3,3-dimethylbutanoyl]-N-[(2R,3S)-2-ethoxy-5-oxooxolan-3-yl]pyrrolidine-2-carboxamide
 related_synonym: Formula=C24H33ClN4O6;   InChI=1S/C24H33ClN4O6/c1-5-34-23-16(12-18(30)35-23)27-21(32)17-7-6-10-29(17)22(33)19(24(2,3)4)28-20(31)13-8-9-15(26)14(25)11-13/h8-9,11,16-17,19,23H,5-7,10,12,26H2,1-4H3,(H,27,32)(H,28,31)/t16-,17-,19+,23+/m0/s1;   InChIKey=SJDDOCKBXFJEJB-MOKWFATOSA-N;   SMILES=ClC=1C=C(C(=O)N[C@@H](C(C)(C)C)C(=O)N2[C@@H](CCC2)C(=O)N[C@@H]3[C@@H](OC(=O)C3)OCC)C=CC1N
 xref: CAS:273404-37-8;   Chemspider:9572992;   KEGG:D10416
 xref_mesh: MESH:C520022



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Belnacasan term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Casp1 caspase 1 decreases activity
multiple interactions
ISO
EXP
belnacasan results in decreased activity of CASP1 protein
belnacasan inhibits the reaction [[Acrolein co-treated with Lipopolysaccharides] results in increased cleavage of CASP1 protein]
belnacasan inhibits the reaction [Toluene 2,4-Diisocyanate results in increased expression of CASP1 protein]
CTD PMID:30205151 PMID:31070765 PMID:34935985 NCBI chr 8:2,587,812...2,597,403
Ensembl chr 8:2,587,831...2,597,383
JBrowse link
G Cxcl1 C-X-C motif chemokine ligand 1 multiple interactions EXP belnacasan inhibits the reaction [Clozapine results in increased secretion of CXCL1 protein] CTD PMID:34935985 NCBI chr14:17,193,364...17,195,143
Ensembl chr14:17,193,365...17,195,215
JBrowse link
G Il18 interleukin 18 multiple interactions ISO belnacasan inhibits the reaction [[Acrolein co-treated with Lipopolysaccharides] results in increased expression of IL18 protein]
belnacasan inhibits the reaction [Toluene 2,4-Diisocyanate results in increased expression of IL18 protein]
CTD PMID:30205151 PMID:31070765 NCBI chr 8:50,904,630...50,932,887
Ensembl chr 8:50,906,960...50,932,887
JBrowse link
G Il1b interleukin 1 beta multiple interactions ISO
EXP
belnacasan inhibits the reaction [Toluene 2,4-Diisocyanate results in increased expression of IL1B protein]
belnacasan inhibits the reaction [Clozapine results in increased secretion of IL1B protein]
belnacasan inhibits the reaction [[Acrolein co-treated with Lipopolysaccharides] results in increased expression of IL1B protein]
CTD PMID:30205151 PMID:31070765 PMID:34935985 NCBI chr 3:116,577,005...116,583,386
Ensembl chr 3:116,577,010...116,583,415
JBrowse link
G Tnf tumor necrosis factor multiple interactions EXP belnacasan inhibits the reaction [Clozapine results in increased secretion of TNF protein] CTD PMID:34935985 NCBI chr20:3,622,011...3,624,629
Ensembl chr20:3,622,011...3,624,629
JBrowse link

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 20072
    chemical entity 20071
      group 20002
        organic group 18965
          amino-acid residue 9516
            peptide 9515
              oligopeptide 1291
                dipeptide 391
                  Belnacasan 5
Path 2
Term Annotations click to browse term
  CHEBI ontology 20072
    subatomic particle 20071
      composite particle 20071
        hadron 20071
          baryon 20071
            nucleon 20071
              atomic nucleus 20071
                atom 20071
                  main group element atom 19971
                    p-block element atom 19971
                      carbon group element atom 19894
                        carbon atom 19887
                          organic molecular entity 19887
                            organic group 18965
                              organic divalent group 18951
                                organodiyl group 18951
                                  carbonyl group 18903
                                    carbonyl compound 18903
                                      carboxylic acid 18601
                                        carboacyl group 17713
                                          univalent carboacyl group 17713
                                            carbamoyl group 17552
                                              carboxamide 17552
                                                peptide 9515
                                                  oligopeptide 1291
                                                    dipeptide 391
                                                      Belnacasan 5
paths to the root