Target
Caspase-3
Ligand
BDBM50149213
Substrate
n/a
Meas. Tech.
ChEMBL_46677 (CHEMBL658635)
Ki
>1000000±n/a nM
Citation
 Erlanson, DAMcDowell, RSO'Brien, T Fragment-based drug discovery. J Med Chem 47:3463-82 (2004) [PubMed]  Article 
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:
BDBM50149213
Synonyms:
2-Hydroxy-5-methylsulfamoyl-benzoic acid | CHEMBL115512
Type:
Small organic molecule
Emp. Form.:
C8H9NO5S
Mol. Mass.:
231.226
SMILES:
CNS(=O)(=O)c1ccc(O)c(c1)C(O)=O
Structure:
Search PDB for entries with ligand similarity: