BDBM50406202 CHEMBL343675

SMILES: CCOC(=O)Nc1ccc2c(c1)nc(OCC)oc2=O

InChI Key: InChIKey=GCQXGGDPSKIGPI-UHFFFAOYSA-N

Data: 1 KI  1 K_off  1 K_on

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 = 50406202   

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))	BDBM50406202 (CHEMBL343675) Show SMILES CCOC(=O)Nc1ccc2c(c1)nc(OCC)oc2=O Show InChI InChI=1S/C13H14N2O5/c1-3-18-12(17)14-8-5-6-9-10(7-8)15-13(19-4-2)20-11(9)16/h5-7H,3-4H2,1-2H3,(H,14,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	15.8	n/a	n/a	n/a	n/a	0.00107	6.03E+4	n/a	n/a
Syntex Research Curated by ChEMBL					Assay Description Component deacylation rate constant for interaction with human leukocyte elastase				J Med Chem 33: 464-79 (1990) Checked by Author BindingDB Entry DOI: 10.7270/Q2PR7X6X
					More data for this Ligand-Target Pair