BDBM50518621 CHEMBL4561263

SMILES: COc1cccc(n1)C(NC(=O)OCc1ccccc1)P(=O)(Oc1ccccc1)Oc1ccccc1

InChI Key: InChIKey=ASJASJHUUADEDN-UHFFFAOYSA-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 = 50518621   

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
ATP-dependent Clp protease proteolytic subunit (Escherichia coli (strain K12))	BDBM50518621 (CHEMBL4561263) Show SMILES COc1cccc(n1)C(NC(=O)OCc1ccccc1)P(=O)(Oc1ccccc1)Oc1ccccc1 Show InChI InChI=1S/C27H25N2O6P/c1-32-25-19-11-18-24(28-25)26(29-27(30)33-20-21-12-5-2-6-13-21)36(31,34-22-14-7-3-8-15-22)35-23-16-9-4-10-17-23/h2-19,26H,20H2,1H3,(H,29,30)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Antwerp Curated by ChEMBL					Assay Description Inhibition of Escherichia coli C-terminal His6-tagged ClpP expressed Escherichia coli SG1146a using Suc-LY-AMC as substrate preincubated for 10 mins ...				J Med Chem 62: 774-797 (2019) Article DOI: 10.1021/acs.jmedchem.8b01466
					More data for this Ligand-Target Pair