Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Beta-lactamase' and Ligand = 'BDBM50348178'   

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
Beta-lactamase (Pseudomonas aeruginosa (PAO1))	BDBM50348178 (CHEMBL1800867) Show SMILES C[N+]1(C)CCC[C@@H](CC1)NC(=O)N1CC[C@@H]2[C@H]1C(=O)N2S([O-])(=O)=O |r| Show InChI InChI=1S/C14H24N4O5S/c1-18(2)8-3-4-10(6-9-18)15-14(20)16-7-5-11-12(16)13(19)17(11)24(21,22)23/h10-12H,3-9H2,1-2H3,(H-,15,20,21,22,23)/t10-,11+,12-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Labs Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa CL5701 AmpC by spectrophotometric assay				Bioorg Med Chem Lett 21: 4267-70 (2011) Article DOI: 10.1016/j.bmcl.2011.05.065 BindingDB Entry DOI: 10.7270/Q2WW7J1C
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