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Target
Caspase-3
Ligand
BDBM71105
Substrate
n/a
IC50
>100000±0 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:
BDBM71105
Synonyms:
2-[2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]ethyl]-5-methyl-4H-pyrazol-3-one;hydrobromide | 2-[2-[4-(4-methoxyphenyl)-2-thiazolyl]ethyl]-5-methyl-4H-pyrazol-3-one;hydrobromide | 2-[2-[4-(4-methoxyphenyl)thiazol-2-yl]ethyl]-5-methyl-2-pyrazolin-3-one;hydrobromide | MLS001004361 | SMR000347900 | cid_16195975
Type:
Small organic molecule
Emp. Form.:
C16H17N3O2S
Mol. Mass.:
315.39
SMILES:
COc1ccc(cc1)-c1csc(CCn2[nH]c(C)cc2=O)n1
Structure:
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