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TargetCaspase-1
LigandBDBM50602630
Substrate/Competitorn/a
Meas. Tech.ChEMBL_2241713 (CHEMBL5155923)
IC50 53500±n/a nM
Citation Ulgheri, FSpanu, PDeligia, FLoriga, GFuggetta, MPde Haan, IChandgudge, AGroves, MDomling, A Design, synthesis and biological evaluation of 1,5-disubstituted ?-amino tetrazole derivatives as non-covalent inflammasome-caspase-1 complex inhibitors with potential application against immune and inflammatory disorders. Eur J Med Chem229:0 (2022) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Caspase-1
Name:Caspase-1
Synonyms:CASP1 | CASP1_HUMAN | Caspase | Caspase 1 | ICE | IL1BC | IL1BCE | Interleukin-1 beta convertase | Interleukin-1 beta-converting enzyme
Type:Enzyme
Mol. Mass.:45154.13
Organism:Homo sapiens (Human)
Description:P29466
Residue:404
Sequence:
MADKVLKEKRKLFIRSMGEGTINGLLDELLQTRVLNKEEMEKVKRENATVMDKTRALIDS
VIPKGAQACQICITYICEEDSYLAGTLGLSADQTSGNYLNMQDSQGVLSSFPAPQAVQDN
PAMPTSSGSEGNVKLCSLEEAQRIWKQKSAEIYPIMDKSSRTRLALIICNEEFDSIPRRT
GAEVDITGMTMLLQNLGYSVDVKKNLTASDMTTELEAFAHRPEHKTSDSTFLVFMSHGIR
EGICGKKHSEQVPDILQLNAIFNMLNTKNCPSLKDKPKVIIIQACRGDSPGVVWFKDSVG
VSGNLSLPTTEEFEDDAIKKAHIEKDFIAFCSSTPDNVSWRHPTMGSVFIGRLIEHMQEY
ACSCDVEEIFRKVRFSFEQPDGRAQMPTTERVTLTRCFYLFPGH
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  Blast E-value cutoff:
BDBM50602630
n/a
NameBDBM50602630
Synonyms:CHEMBL5178554
TypeSmall organic molecule
Emp. Form.C25H29N6NaO4
Mol. Mass.500.5253
SMILES[Na;v0+].[#8]-[#6](-[#6]-[#7]-[#6@@H](-c1nnnn1-[#6]-[#6]-[#6]-[#6](=O)-[#7]-1-[#6]-[#6]-c2ccccc2-[#6]-1)-c1ccccc1)-[#6]-[#6](-[#8-])=O |r|
Structure
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