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Target
Caspase-3
Ligand
BDBM93628
Substrate
n/a
IC50
2150±132 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:
BDBM93628
Synonyms:
5-amino-4-keto-N-[(E)-p-anisylideneamino]-3-phenyl-thieno[3,4-d]pyridazine-1-carboxamide | 5-amino-N'-(4-methoxybenzylidene)-4-oxo-3-phenyl-3,4-dihydrothieno[3,4-d]pyridazine-1-carbohydrazide | 5-amino-N-[(E)-(4-methoxyphenyl)methylideneamino]-4-oxo-3-phenyl-1-thieno[3,4-d]pyridazinecarboxamide | 5-amino-N-[(E)-(4-methoxyphenyl)methylideneamino]-4-oxo-3-phenylthieno[3,4-d]pyridazine-1-carboxamide | 5-azanyl-N-[(E)-(4-methoxyphenyl)methylideneamino]-4-oxidanylidene-3-phenyl-thieno[3,4-d]pyridazine-1-carboxamide | MLS000545662 | SMR000164098 | cid_6871359
Type:
Small organic molecule
Emp. Form.:
C21H17N5O3S
Mol. Mass.:
419.456
SMILES:
COc1ccc(\C=N\NC(=O)c2nn(-c3ccccc3)c(=O)c3c(N)scc23)cc1
Structure:
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