Reaction Details Report a problem with these data
Target
Chymotrypsinogen B
Ligand
BDBM50025871
Substrate
n/a
Meas. Tech.
ChEMBL_216621 (CHEMBL819193)
Ki
7400±n/a nM
Citation
 Kinder, DH; Katzenellenbogen, JA Acylamino boronic acids and difluoroborane analogues of amino acids: potent inhibitors of chymotrypsin and elastase. J Med Chem 28:1917-25 (1986) [PubMed]  Article 
Target
Name:
Chymotrypsinogen B
Synonyms:
Beta-chymotrypsin | CTRB | CTRB1 | CTRB1_HUMAN | Chymotrypsin B chain A | Chymotrypsin B chain B | Chymotrypsin B chain C | Chymotrypsinogen B | Synonyms=CTRB
Type:
PROTEIN
Mol. Mass.:
27713.98
Organism:
Homo sapiens (Human)
Description:
ChEMBL_10909
Residue:
263
Sequence:
MASLWLLSCFSLVGAAFGCGVPAIHPVLSGLSRIVNGEDAVPGSWPWQVSLQDKTGFHFCGGSLISEDWVVTAAHCGVRTSDVVVAGEFDQGSDEENIQVLKIAKVFKNPKFSILTVNNDITLLKLATPARFSQTVSAVCLPSADDDFPAGTLCATTGWGKTKYNANKTPDKLQQAALPLLSNAECKKSWGRRITDVMICAGASGVSSCMGDSGGPLVCQKDGAWTLVGIVSWGSDTCSTSSPGVYARVTKLIPWVQKILAAN
  
Inhibitor
Name:
BDBM50025871
Synonyms:
CHEMBL430767 | N-(2-phenyl ethyl)acetamide difluoroborane
Type:
Small organic molecule
Emp. Form.:
C10H12BF2NO
Mol. Mass.:
211.016
SMILES:
CC(=O)NC(Cc1ccccc1)B(F)F
Structure:
Search PDB for entries with ligand similarity: