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Target
Caspase-3
Ligand
BDBM10309
Substrate
n/a
Meas. Tech.
ChEMBL_582859 (CHEMBL1061695)
IC50
2800±n/a nM
Citation
 Lakshmi, PJ; Kumar, BV; Nayana, RS; Mohan, MS; Bolligarla, R; Das, SK; Bhanu, MU; Kondapi, AK; Ravikumar, M Design, synthesis, and discovery of novel non-peptide inhibitor of Caspase-3 using ligand based and structure based virtual screening approach. Bioorg Med Chem 17:6040-7 (2009) [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:
BDBM10309
Synonyms:
5-(pyrrolidine-1-sulfonyl)-2,3-dihydro-1H-indole-2,3-dione | 5-[1-(Pyrrolidinyl)sulfonyl]isatin | Isatin Sulfonamide 20
Type:
Small organic molecule
Emp. Form.:
C12H12N2O4S
Mol. Mass.:
280.3
SMILES:
O=C1Nc2ccc(cc2C1=O)S(=O)(=O)N1CCCC1
Structure:
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