BDBM230386 US9340507, 42

SMILES: COC[C@H](C)n1cc(C(=O)NCc2ccc(cc2)S(C)(=O)=O)c(=O)c(c1C)-c1cccc(c1)C(F)F

InChI Key: InChIKey=FXTDDAOBCODVHI-INIZCTEOSA-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 = 230386   

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))	BDBM230386 (US9340507, 42) Show SMILES COC[C@H](C)n1cc(C(=O)NCc2ccc(cc2)S(C)(=O)=O)c(=O)c(c1C)-c1cccc(c1)C(F)F |r| Show InChI InChI=1S/C26H28F2N2O5S/c1-16(15-35-3)30-14-22(26(32)29-13-18-8-10-21(11-9-18)36(4,33)34)24(31)23(17(30)2)19-6-5-7-20(12-19)25(27)28/h5-12,14,16,25H,13,15H2,1-4H3,(H,29,32)/t16-/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	8.10	n/a	n/a	n/a	n/a	7.5	25
Boehringer Ingelheim International GmbH US Patent					Assay Description Compound buffer: 100 mM Tris, 500 mM NaCl, adjusted to pH 7.5; Assay buffer: 100 mM Tris, 500 mM NaCl, adjusted to pH 7.5, containing 0.01% BSA. Test...				US Patent US9340507 (2016) BindingDB Entry DOI: 10.7270/Q2ZC81RD
					More data for this Ligand-Target Pair