Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '3-oxoacyl-ACP synthase' and Ligand = 'BDBM50465707'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
3-oxoacyl-ACP synthase (Pseudomonas aeruginosa)	BDBM50465707 (CHEMBL4292096) Show SMILES CCCCCCS(=O)(=O)c1ncc(cn1)-n1ccnn1 Show InChI InChI=1S/C12H17N5O2S/c1-2-3-4-5-8-20(18,19)12-13-9-11(10-14-12)17-7-6-15-16-17/h6-7,9-10H,2-5,8H2,1H3	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Nottingham Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa PqsD				J Med Chem 61: 10385-10402 (2018) Article DOI: 10.1021/acs.jmedchem.8b00540 BindingDB Entry DOI: 10.7270/Q2XP77NZ
					More data for this Ligand-Target Pair