Reaction Details Report a problem with these data
Target
Neutrophil elastase
Ligand
BDBM50603195
Substrate
n/a
Meas. Tech.
ChEMBL_2243357 (CHEMBL5157567)
IC50
2980±n/a nM
Citation
 Hwang, J; Strange, N; Mazraani, R; Phillips, MJ; Gamble, AB; Huston, WM; Tyndall, JDA Design, synthesis and biological evaluation of P2-modified proline analogues targeting the HtrA serine protease in Chlamydia. Eur J Med Chem 230:0 (2022) [PubMed] 
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:
BDBM50603195
Synonyms:
CHEMBL5188060
Type:
Small organic molecule
Emp. Form.:
C37H53N6O8P
Mol. Mass.:
740.8259
SMILES:
CC(C)C(NC(=O)[C@@H]1C[C@@H](CN1C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)n1nncc1C(C)(C)O)P(=O)(Oc1ccccc1)Oc1ccccc1 |r|
Structure:
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