BDBM211910 US9290459, 48.4

SMILES: CS(=O)(=O)c1cc(ccc1[C@H]1N(C(=O)N[C@H]2CC[C@H](O)C2)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)(F)F)C#N

InChI Key: InChIKey=GROIZKGWAOMLQO-FXJWSJNKSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 211910   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Leukocyte elastase (Homo sapiens (Human))	BDBM211910 (US9290459, 48.4) Show SMILES CS(=O)(=O)c1cc(ccc1[C@H]1N(C(=O)N[C@H]2CC[C@H](O)C2)C(=O)N(C2=C1C(=O)CC2)c1cccc(c1)C(F)(F)F)C#N |r,c:26| Show InChI InChI=1S/C28H25F3N4O6S/c1-42(40,41)23-11-15(14-32)5-8-20(23)25-24-21(9-10-22(24)37)34(18-4-2-3-16(12-18)28(29,30)31)27(39)35(25)26(38)33-17-6-7-19(36)13-17/h2-5,8,11-12,17,19,25,36H,6-7,9-10,13H2,1H3,(H,33,38)/t17-,19-,25+/m0/s1	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 US9290459 (2016) BindingDB Entry DOI: 10.7270/Q2KS6QD5
					More data for this Ligand-Target Pair