Reaction Details Report a problem with these data
Target
Caspase-3
Ligand
BDBM61195
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:
BDBM61195
Synonyms:
MLS000765857 | N'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-4-nitro-benzohydrazide | N'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-4-nitrobenzohydrazide | N'-(2,6-dipyrrolidinopyrimidin-4-yl)-4-nitro-benzohydrazide | N'-[2,6-bis(1-pyrrolidinyl)-4-pyrimidinyl]-4-nitrobenzohydrazide | SMR000278963 | cid_3121369
Type:
Small organic molecule
Emp. Form.:
C19H23N7O3
Mol. Mass.:
397.431
SMILES:
[O-][N+](=O)c1ccc(cc1)C(=O)NNc1cc(nc(n1)N1CCCC1)N1CCCC1
Structure:
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