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Target
Caspase-3
Ligand
BDBM50040332
Substrate
n/a
Meas. Tech.
ChEMBL_1443755 (CHEMBL3371728)
IC50
306±n/a nM
Citation
 Li, Z; Pan, Y; Zhong, W; Zhu, Y; Zhao, Y; Li, L; Liu, W; Zhou, H; Yang, C Synthesis and evaluation of N-acyl-substituted 1,2-benzisothiazol-3-one derivatives as caspase-3 inhibitors. Bioorg Med Chem 22:6735-45 (2015) [PubMed]  Article 
Target
Name:
Caspase-3
Synonyms:
Apopain | CASP-3 | CASP3 | CASP3_HUMAN | CPP-32 | CPP32 | Caspase 3 | Caspase-3 subunit p12 | Caspase-3 subunit p17 | Cysteine protease CPP32 | SCA-1 | SREBP cleavage activity 1 | Yama protein | caspase-3 preproprotein
Type:
Hydrolase; heterotetramer of two heterodimers
Mol. Mass.:
31607.55
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
277
Sequence:
MENTENSVDSKSIKNLEPKIIHGSESMDSGISLDNSYKMDYPEMGLCIIINNKNFHKSTGMTSRSGTDVDAANLRETFRNLKYEVRNKNDLTREEIVELMRDVSKEDHSKRSSFVCVLLSHGEEGIIFGTNGPVDLKKITNFFRGDRCRSLTGKPKLFIIQACRGTELDCGIETDSGVDDDMACHKIPVEADFLYAYSTAPGYYSWRNSKDGSWFIQSLCAMLKQYADKLEFMHILTRVNRKVATEFESFSFDATFHAKKQIPCIVSMLTKELYFYH
  
Inhibitor
Name:
BDBM50040332
Synonyms:
CHEMBL3360057
Type:
Small organic molecule
Emp. Form.:
C18H17NO2S
Mol. Mass.:
311.398
SMILES:
O=C(CCCCc1ccccc1)n1sc2ccccc2c1=O
Structure:
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