Target
Chymotrypsinogen A
Ligand
BDBM50077011
Substrate
n/a
Meas. Tech.
α-Chymotrypsin Inhibition Assay
pH
7.6±n/a
IC50
1.17e+4± 8e+2 nM
Comments
extracted
Citation
 Marasini, BPRahim, FPerveen, SKarim, AMohammed Khan, KAtta-Ur-Rahman, nullChoudhary, MI Synthesis, structure-activity relationships studies of benzoxazinone derivatives as a-chymotrypsin inhibitors. Bioorg Chem 70:210-221 (2017) [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:
BDBM50077011
Synonyms:
2-Phenyl-4H-3,1-benzoxazin-4-one (3) | 2-Phenyl-benzo[d][1,3]oxazin-4-one | CHEMBL24449
Type:
Small organic molecule
Emp. Form.:
C14H9NO2
Mol. Mass.:
223.2268
SMILES:
O=c1oc(nc2ccccc12)-c1ccccc1
Structure:
Search PDB for entries with ligand similarity: