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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


show annotations for term's descendants           Sort by:
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 19880
    chemical entity 19878
      group 19831
        organic group 18983
          amino-acid residue 11442
            peptide 11442
              oligopeptide 1349
                dipeptide 413
                  Belnacasan 5
Path 2
Term Annotations click to browse term
  CHEBI ontology 19880
    subatomic particle 19878
      composite particle 19878
        hadron 19878
          baryon 19878
            nucleon 19878
              atomic nucleus 19878
                atom 19878
                  main group element atom 19817
                    p-block element atom 19817
                      carbon group element atom 19757
                        carbon atom 19754
                          organic molecular entity 19754
                            heteroorganic entity 19512
                              organochalcogen compound 19275
                                organooxygen compound 19191
                                  carbon oxoacid 18658
                                    carboxylic acid 18655
                                      carboacyl group 17699
                                        univalent carboacyl group 17699
                                          carbamoyl group 17550
                                            carboxamide 17550
                                              peptide 11442
                                                oligopeptide 1349
                                                  dipeptide 413
                                                    Belnacasan 5
paths to the root