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Target
Caspase-3
Ligand
BDBM93652
Substrate
n/a
IC50
46600±1340 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:
BDBM93652
Synonyms:
2-[3-isopropyl-7-[(3-methylbenzyl)amino]benzimidazol-5-yl]oxybutan-1-ol | 2-[7-[(3-methylphenyl)methylamino]-3-propan-2-yl-benzimidazol-5-yl]oxybutan-1-ol | 2-[7-[(3-methylphenyl)methylamino]-3-propan-2-ylbenzimidazol-5-yl]oxybutan-1-ol | 2-[[7-[(3-methylphenyl)methylamino]-3-propan-2-yl-5-benzimidazolyl]oxy]-1-butanol | MLS002471433 | SMR001395099 | cid_44143077
Type:
Small organic molecule
Emp. Form.:
C22H29N3O2
Mol. Mass.:
367.4846
SMILES:
CCC(CO)Oc1cc(NCc2cccc(C)c2)c2ncn(C(C)C)c2c1
Structure:
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