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Found 1 hit Enz. Inhib. hit(s) with Target = 'Neutrophil elastase' and Ligand = 'BDBM405545'   
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))		BDBM405545
PNG
(USRE47493, Example 75.18)
Show SMILES C[C@H]1CCCC1NC(=O)N1[C@@H](C2=C(CCCC2=O)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1S(C)(O)O)C#N |r,t:12|
Show InChI InChI=1S/C30H31F3N4O5S/c1-17-6-3-9-22(17)35-28(39)37-27(21-13-12-18(16-34)14-25(21)43(2,41)42)26-23(10-5-11-24(26)38)36(29(37)40)20-8-4-7-19(15-20)30(31,32)33/h4,7-8,12-15,17,22,27,41-42H,3,5-6,9-11H2,1-2H3,(H,35,39)/t17-,22?,27+/m0/s1
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US Patent
n/an/a<1n/an/an/an/an/an/a



Boehringer Ingelheim International GmbH

US Patent


Assay Description
Materials: Human neutrophil elastase was purchased from Calbiochem (Cat.No.: 324681) and the elastase substrate MeOSuc-Ala-Ala-Pro-Val-AMC from Bache...

US Patent USRE47493 (2019)


BindingDB Entry DOI: 10.7270/Q2668GJJ
More data for this
Ligand-Target Pair