Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'PA-I galactophilic lectin' and Ligand = 'BDBM50034083'   

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
PA-I galactophilic lectin (Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)	BDBM50034083 (CHEMBL3358629) Show SMILES OC[C@H]1O[C@@H](OCCOCCOCCn2cc(CO)nn2)[C@H](O)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C15H27N3O9/c19-8-10-7-18(17-16-10)1-2-24-3-4-25-5-6-26-15-14(23)13(22)12(21)11(9-20)27-15/h7,11-15,19-23H,1-6,8-9H2/t11-,12+,13+,14-,15-/m1/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.50E+5	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon 1& VetAgro Sup Curated by ChEMBL					Assay Description Binding affinity to Pseudomonas aeruginosa LecA by ITC method				J Med Chem 57: 10275-89 (2014) Article DOI: 10.1021/jm500038p BindingDB Entry DOI: 10.7270/Q2251KSP
					More data for this Ligand-Target Pair