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Target
Caspase-1
Ligand
BDBM50091577
Substrate
n/a
Meas. Tech.
ChEMBL_46496 (CHEMBL659499)
IC50
10±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:
BDBM50091577
Synonyms:
(S)-3-(2-{3-[(Naphthalene-1-carbonyl)-amino]-2-oxo-2H-pyridin-1-yl}-2-phenyl-acetylamino)-4-oxo-5-phenoxy-pentanoic acid | 3-(2-{3-[(Naphthalene-1-carbonyl)-amino]-2-oxo-2H-pyridin-1-yl}-2-phenyl-acetylamino)-4-oxo-5-phenoxy-pentanoic acid | CHEMBL26719
Type:
Small organic molecule
Emp. Form.:
C35H29N3O7
Mol. Mass.:
603.6207
SMILES:
OC(=O)C[C@H](NC(=O)C(c1ccccc1)n1cccc(NC(=O)c2cccc3ccccc23)c1=O)C(=O)COc1ccccc1
Structure:
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