BDBM50284794 CHEMBL36689::Sodium; (R)-3-acetoxymethyl-5,5,8-trioxo-7-vinylidene-5lambda*6*-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylate

SMILES: CC(=O)OCC1=C(N2[C@@H](C(=C=C)C2=O)S(=O)(=O)C1)C([O-])=O

InChI Key: InChIKey=ZLYQUOKXGNQRIC-LLVKDONJSA-M

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50284794   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Beta-lactamase (Enterobacter cloacae)	BDBM50284794 (CHEMBL36689 | Sodium; (R)-3-acetoxymethyl-5,5,8-tr...) Show SMILES CC(=O)OCC1=C(N2[C@@H](C(=C=C)C2=O)S(=O)(=O)C1)C([O-])=O |t:5| Show InChI InChI=1S/C12H11NO7S/c1-3-8-10(15)13-9(12(16)17)7(4-20-6(2)14)5-21(18,19)11(8)13/h11H,1,4-5H2,2H3,(H,16,17)/p-1/t11-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity against beta-Lactamase enzyme derived from Enterobacter cloacae SC 12368 E-2				Bioorg Med Chem Lett 5: 1513-1518 (1995) Article DOI: 10.1016/0960-894X(95)00249-S BindingDB Entry DOI: 10.7270/Q2ZW1MDG
					More data for this Ligand-Target Pair
Beta-lactamase (Enterobacter cloacae)	BDBM50284794 (CHEMBL36689 | Sodium; (R)-3-acetoxymethyl-5,5,8-tr...) Show SMILES CC(=O)OCC1=C(N2[C@@H](C(=C=C)C2=O)S(=O)(=O)C1)C([O-])=O |t:5| Show InChI InChI=1S/C12H11NO7S/c1-3-8-10(15)13-9(12(16)17)7(4-20-6(2)14)5-21(18,19)11(8)13/h11H,1,4-5H2,2H3,(H,16,17)/p-1/t11-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity against beta-Lactamase enzyme derived from Enterobacter cloacae P99				Bioorg Med Chem Lett 5: 1513-1518 (1995) Article DOI: 10.1016/0960-894X(95)00249-S BindingDB Entry DOI: 10.7270/Q2ZW1MDG
					More data for this Ligand-Target Pair
Beta-lactamase (TEM-1) (Escherichia coli)	BDBM50284794 (CHEMBL36689 | Sodium; (R)-3-acetoxymethyl-5,5,8-tr...) Show SMILES CC(=O)OCC1=C(N2[C@@H](C(=C=C)C2=O)S(=O)(=O)C1)C([O-])=O |t:5| Show InChI InChI=1S/C12H11NO7S/c1-3-8-10(15)13-9(12(16)17)7(4-20-6(2)14)5-21(18,19)11(8)13/h11H,1,4-5H2,2H3,(H,16,17)/p-1/t11-/m1/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity against beta-Lactamase enzyme derived from Escherichia coli WC3310 TEM-2				Bioorg Med Chem Lett 5: 1513-1518 (1995) Article DOI: 10.1016/0960-894X(95)00249-S BindingDB Entry DOI: 10.7270/Q2ZW1MDG
					More data for this Ligand-Target Pair