Reaction Details Report a problem with these data
Target
Neutrophil elastase
Ligand
BDBM50060337
Substrate
n/a
Meas. Tech.
ChEMBL_63661 (CHEMBL675717)
IC50
390000±n/a nM
Citation
 Buynak, JD; Rao, AS; Ford, GP; Carver, C; Adam, G; Geng, B; Bachmann, B; Shobassy, S; Lackey, S 7-alkylidenecephalosporin esters as inhibitors of human leukocyte elastase. J Med Chem 40:3423-33 (1997) [PubMed]  Article 
Target
Name:
Neutrophil elastase
Synonyms:
Bone marrow serine protease | Chymotrypsin | Coagulation factor X | ELA2 | ELANE | ELNE_HUMAN | Elastase | Elastase-2 | HLE | Human leukocyte elastase | Leukocyte elastase | Leukocyte elastase (HLE) | Medullasin | Neutrophil elastase | Neutrophil elastase (HNE) | Neutrophil elastase (NE) | PMN elastase | Thrombin | Trypsin
Type:
Enzyme
Mol. Mass.:
28532.38
Organism:
Homo sapiens (Human)
Description:
P08246
Residue:
267
Sequence:
MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH
  
Inhibitor
Name:
BDBM50060337
Synonyms:
3-Acetoxymethyl-7-[1-bromo-meth-(E)-ylidene]-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester | CHEMBL114010
Type:
Small organic molecule
Emp. Form.:
C24H20BrNO5S
Mol. Mass.:
514.388
SMILES:
CC(=O)OCC1=C(N2C(SC1)\C(=C\Br)C2=O)C(=O)OC(c1ccccc1)c1ccccc1 |t:5|
Structure:
Search PDB for entries with ligand similarity: