Reaction Details Report a problem with these data
Target
Caspase-1
Ligand
BDBM54734
Substrate
n/a
Meas. Tech.
Dose Response confirmation of inhibitors of NALP1 in yeast using a Caspase-1-ASC counter screen.
IC50
7100±n/a nM
Citation
 PubChem, PC Dose Response confirmation of inhibitors of NALP1 in yeast using a Caspase-1-ASC counter screen. PubChem Bioassay (2010)[AID] 
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:
BDBM54734
Synonyms:
(Z)-4-(3-nitroanilino)-4-oxo-2-butenoic acid methyl ester | (Z)-4-keto-4-(3-nitroanilino)but-2-enoic acid methyl ester | MLS000723019 | SMR000236409 | cid_12005927 | methyl (Z)-4-(3-nitroanilino)-4-oxobut-2-enoate | methyl (Z)-4-[(3-nitrophenyl)amino]-4-oxidanylidene-but-2-enoate
Type:
Small organic molecule
Emp. Form.:
C11H10N2O5
Mol. Mass.:
250.2075
SMILES:
COC(=O)\C=C/C(=O)Nc1cccc(c1)[N+]([O-])=O
Structure:
Search PDB for entries with ligand similarity: