Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neutrophil elastase' and Ligand = 'BDBM211474'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Neutrophil elastase (Homo sapiens (Human))	BDBM211474 (US9290457, Example 1.16) Show SMILES CN1C(C(C(C)=O)=C(C)N(C1=O)c1cccc(c1)C(F)(F)F)c1ccc(cc1C(=O)NCCCO)C#N |t:6| Show InChI InChI=1S/C26H25F3N4O4/c1-15-22(16(2)35)23(20-9-8-17(14-30)12-21(20)24(36)31-10-5-11-34)32(3)25(37)33(15)19-7-4-6-18(13-19)26(27,28)29/h4,6-9,12-13,23,34H,5,10-11H2,1-3H3,(H,31,36)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<1	n/a	n/a	n/a	n/a	7.5	25
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 Bach...				US Patent US9290457 (2016) BindingDB Entry DOI: 10.7270/Q2QJ7G4W
					More data for this Ligand-Target Pair