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Target
Caspase-1
Ligand
BDBM50091568
Substrate
n/a
Meas. Tech.
ChEMBL_46496 (CHEMBL659499)
IC50
46±n/a nM
Citation
 Talanian, RV; Brady, KD; Cryns, VL Caspases as targets for anti-inflammatory and anti-apoptotic drug discovery. J Med Chem 43:3351-71 (2000) [PubMed]  Article 
Target
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:
MADKVLKEKRKLFIRSMGEGTINGLLDELLQTRVLNKEEMEKVKRENATVMDKTRALIDSVIPKGAQACQICITYICEEDSYLAGTLGLSADQTSGNYLNMQDSQGVLSSFPAPQAVQDNPAMPTSSGSEGNVKLCSLEEAQRIWKQKSAEIYPIMDKSSRTRLALIICNEEFDSIPRRTGAEVDITGMTMLLQNLGYSVDVKKNLTASDMTTELEAFAHRPEHKTSDSTFLVFMSHGIREGICGKKHSEQVPDILQLNAIFNMLNTKNCPSLKDKPKVIIIQACRGDSPGVVWFKDSVGVSGNLSLPTTEEFEDDAIKKAHIEKDFIAFCSSTPDNVSWRHPTMGSVFIGRLIEHMQEYACSCDVEEIFRKVRFSFEQPDGRAQMPTTERVTLTRCFYLFPGH
  
Inhibitor
Name:
BDBM50091568
Synonyms:
3-(2-{5-[(Naphthalene-1-carbonyl)-amino]-6-oxo-6H-pyrimidin-1-yl}-hexanoylamino)-4-oxo-5-phenoxy-pentanoic acid | CHEMBL324470
Type:
Small organic molecule
Emp. Form.:
C32H32N4O7
Mol. Mass.:
584.6191
SMILES:
CCCCC(C(=O)N[C@@H](CC(O)=O)C(=O)COc1ccccc1)n1cncc(NC(=O)c2cccc3ccccc23)c1=O
Structure:
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