Reaction Details Report a problem with these data
Target
Chymotrypsinogen A
Ligand
BDBM50085363
Substrate
n/a
Meas. Tech.
ChEBML_215994
IC50
140000±n/a nM
Citation
 Hayashi, Y; Iijima, K; Katada, J; Kiso, Y Structure-activity relationship studies of chloromethyl ketone derivatives for selective human chymase inhibitors. Bioorg Med Chem Lett 10:199-201 (2000) [PubMed]  Article 
Target
Name:
Chymotrypsinogen A
Synonyms:
Alpha-chymotrypsin | CTRA_BOVIN | Chymotrypsin A | Chymotrypsin A chain A | Chymotrypsin A chain B | Chymotrypsin A chain C | Chymotrypsinogen A | alpha-Chymotrypsin (α-Chymotrypsin)
Type:
Serine protease
Mol. Mass.:
25670.88
Organism:
Bos taurus (bovine)
Description:
n/a
Residue:
245
Sequence:
CGVPAIQPVLSGLSRIVNGEEAVPGSWPWQVSLQDKTGFHFCGGSLINENWVVTAAHCGVTTSDVVVAGEFDQGSSSEKIQKLKIAKVFKNSKYNSLTINNDITLLKLSTAASFSQTVSAVCLPSASDDFAAGTTCVTTGWGLTRYTNANTPDRLQQASLPLLSNTNCKKYWGTKIKDAMICAGASGVSSCMGDSGGPLVCKKNGAWTLVGIVSWGSSTCSTSTPGVYARVTALVNWVQQTLAAN
  
Inhibitor
Name:
BDBM50085363
Synonyms:
CHEMBL60718 | L-1-Tosylamido-2-phenylethyl chloromethyl ketone | N-Tosyl-L-phenylalanine chloromethyl ketone | N-Tosyl-L-phenylalanyl chloromethyl ketone | N-[(2S)-4-chloro-3-oxo-1-phenylbutan-2-yl]-4-methylbenzenesulfonamide | TPCK | Tos-Phe-CH2Cl | Tosylphenylalanyl chloromethyl ketone | cid_439647 | l-N-(alpha-(Chloroacetyl)phenethyl)-p-toluenesulfonamide
Type:
Small organic molecule
Emp. Form.:
C17H18ClNO3S
Mol. Mass.:
351.848
SMILES:
Cc1ccc(cc1)S(=O)(=O)N[C@@H](Cc1ccccc1)C(=O)CCl |r|
Structure:
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