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Found 1 hit Enz. Inhib. hit(s) with Target = 'Neutrophil elastase' and Ligand = 'BDBM50098813'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Neutrophil elastase


(Homo sapiens (Human))		BDBM50098813
PNG
(3-[1-(5-tert-Butyl-[1,3,4]oxadiazole-2-carbonyl)-2...)
Show SMILES CC(C)OC(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](C(C)C)C(=O)c1nnc(o1)C(C)(C)C
Show InChI InChI=1S/C25H34N4O5/c1-14(2)19(20(30)22-27-28-23(34-22)25(5,6)7)26-21(31)18-12-16-10-8-9-11-17(16)13-29(18)24(32)33-15(3)4/h8-11,14-15,18-19H,12-13H2,1-7H3,(H,26,31)/t18-,19-/m0/s1
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 725n/an/an/an/an/an/an/an/a



Cortech, Inc.

Curated by ChEMBL


Assay Description
Binding constant derived from inhibition of elastase catalyzed hydrolysis of synthetic substrate

J Med Chem 44: 1268-85 (2001)


BindingDB Entry DOI: 10.7270/Q2B858VW
More data for this
Ligand-Target Pair