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Target
Caspase-3
Ligand
BDBM93603
Substrate
n/a
IC50
9260±316 nM
Citation
 PubChem, PC Dose-response confirmation of uHTS inhibitor hits of Sentrin-Specific Protease 8 in a Caspase-3 Fluorescence assay PubChem Bioassay (2012)[AID] 
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:
BDBM93603
Synonyms:
MLS003355872 | N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-quinolinyl)acetamide | N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-quinolyl)acetamide | N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-quinolin-4-yl-ethanamide | N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-quinolin-4-ylacetamide | SMR002044437 | cid_51361425
Type:
Small organic molecule
Emp. Form.:
C26H29N3O
Mol. Mass.:
399.528
SMILES:
O=C(NC1CCCCC1)C(N1CCc2ccccc2C1)c1ccnc2ccccc12
Structure:
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