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Target
Caspase-1
Ligand
BDBM50091574
Substrate
n/a
Meas. Tech.
ChEMBL_46496 (CHEMBL659499)
IC50
13±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:
BDBM50091574
Synonyms:
3-({4-Hydroxy-1-[3-methyl-2-(3-phenyl-allylamino)-butyryl]-pyrrolidine-2-carbonyl}-amino)-4-oxo-5-phenoxy-pentanoic acid | CHEMBL115823
Type:
Small organic molecule
Emp. Form.:
C30H37N3O7
Mol. Mass.:
551.6307
SMILES:
CC(C)[C@H](NC\C=C\c1ccccc1)C(=O)N1CC(O)C[C@H]1C(=O)NC(CC(O)=O)C(=O)COc1ccccc1
Structure:
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