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Target
Neutrophil elastase
Ligand
BDBM50037354
Substrate
n/a
Meas. Tech.
ChEMBL_63836 (CHEMBL674886)
Ki
8.8±n/a nM
Citation
 Bernstein, PR; Andisik, D; Bradley, PK; Bryant, CB; Ceccarelli, C; Damewood, JR; Earley, R; Edwards, PD; Feeney, S; Gomes, BC Nonpeptidic inhibitors of human leukocyte elastase. 3. Design, synthesis, X-ray crystallographic analysis, and structure-activity relationships for a series of orally active 3-amino-6-phenylpyridin-2-one trifluoromethyl ketones. J Med Chem 37:3313-26 (1994) [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:
Human
Description:
P08246
Residue:
267
Sequence:
MTLGRRLACLFLACVLPALLLGGTALASEIVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQRSEDNPCPHPRDPDPASRTH
  
Inhibitor
Name:
BDBM50037354
Synonyms:
CHEMBL113905 | {2-Oxo-6-phenyl-1-[(3,3,3-trifluoro-1-isopropyl-2-oxo-propylcarbamoyl)-methyl]-1,2-dihydro-pyridin-3-yl}-carbamic acid pyridin-2-ylmethyl ester
Type:
Small organic molecule
Emp. Form.:
C26H25F3N4O5
Mol. Mass.:
530.4957
SMILES:
CC(C)C(NC(=O)Cn1c(ccc(NC(=O)OCc2ccccn2)c1=O)-c1ccccc1)C(=O)C(F)(F)F
Structure:
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