BDBM50435718 CHEMBL2392449

SMILES: CCCc1cc(no1)-c1ccc(Oc2ccc(CNC(=O)c3cc(C)on3)cc2O)c(Cl)c1

InChI Key: InChIKey=AXMZYKSEWGUPCB-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 = 50435718   

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
Enoyl-acyl carrier reductase (Toxoplasma gondii)	BDBM50435718 (CHEMBL2392449) Show SMILES CCCc1cc(no1)-c1ccc(Oc2ccc(CNC(=O)c3cc(C)on3)cc2O)c(Cl)c1 Show InChI InChI=1S/C24H22ClN3O5/c1-3-4-17-12-19(27-33-17)16-6-8-22(18(25)11-16)31-23-7-5-15(10-21(23)29)13-26-24(30)20-9-14(2)32-28-20/h5-12,29H,3-4,13H2,1-2H3,(H,26,30)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	137	n/a	n/a	n/a	n/a	n/a	n/a
University of Leeds Curated by ChEMBL					Assay Description Inhibition of Toxoplasma gondii enoyl acyl-carrier protein reductase				Bioorg Med Chem Lett 23: 3551-5 (2013) Article DOI: 10.1016/j.bmcl.2013.04.035 BindingDB Entry DOI: 10.7270/Q2XK8GZ7
					More data for this Ligand-Target Pair