Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Fe(3+)-pyochelin receptor' and Ligand = 'BDBM50444961'   

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
Fe(3+)-pyochelin receptor (Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)	BDBM50444961 (CHEMBL3099911) Show SMILES COc1ccc(N)cc1-c1nc(cs1)C1SC[C@H](N1C)C(O)=O |r| Show InChI InChI=1S/C15H17N3O3S2/c1-18-11(15(19)20)7-23-14(18)10-6-22-13(17-10)9-5-8(16)3-4-12(9)21-2/h3-6,11,14H,7,16H2,1-2H3,(H,19,20)/t11-,14?/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	460	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
UMR 7242 CNRS-Universit£ de Strasbourg Curated by ChEMBL					Assay Description Displacement of Pch-55Fe(III) from Pseudomonas aeruginosa PAD07 FptA after 1 hr in presence of CCCP				Bioorg Med Chem Lett 24: 132-5 (2013) Article DOI: 10.1016/j.bmcl.2013.11.054 BindingDB Entry DOI: 10.7270/Q2J38V1F
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