Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Beta-lactamase' and Ligand = 'BDBM50114508'   

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 (Enterobacter cloacae)	BDBM50114508 (CHEMBL46958 | Disodium; (R)-3-carboxy-5,5,8-trioxo...) Show SMILES [O-]C(=O)C1=C(N2[C@@H](\C(=C/c3ccccn3)C2=O)S(=O)(=O)C1)C([O-])=O |t:3| Show InChI InChI=1S/C14H10N2O7S/c17-11-8(5-7-3-1-2-4-15-7)12-16(11)10(14(20)21)9(13(18)19)6-24(12,22)23/h1-5,12H,6H2,(H,18,19)(H,20,21)/p-2/b8-5-/t12-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
Southern Methodist University Curated by ChEMBL					Assay Description Inhibitory activity against Class C beta-lactamase				Bioorg Med Chem Lett 12: 1663-6 (2002) BindingDB Entry DOI: 10.7270/Q2MC8ZB3
					More data for this Ligand-Target Pair
Beta-lactamase (Escherichia coli)	BDBM50114508 (CHEMBL46958 | Disodium; (R)-3-carboxy-5,5,8-trioxo...) Show SMILES [O-]C(=O)C1=C(N2[C@@H](\C(=C/c3ccccn3)C2=O)S(=O)(=O)C1)C([O-])=O |t:3| Show InChI InChI=1S/C14H10N2O7S/c17-11-8(5-7-3-1-2-4-15-7)12-16(11)10(14(20)21)9(13(18)19)6-24(12,22)23/h1-5,12H,6H2,(H,18,19)(H,20,21)/p-2/b8-5-/t12-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.04E+4	n/a	n/a	n/a	n/a	n/a	n/a
Southern Methodist University Curated by ChEMBL					Assay Description Inhibitory activity against class A TEM-1 beta-lactamase				Bioorg Med Chem Lett 12: 1663-6 (2002) BindingDB Entry DOI: 10.7270/Q2MC8ZB3
					More data for this Ligand-Target Pair