BDBM50260008 CHEMBL4077031

SMILES: O[C@@H]1[C@@H](CNC(=O)c2ccccc2Cl)OC[C@@]1(O)CN1C(=O)c2ccccc2C1=O

InChI Key: InChIKey=RDJVDSWLLNSFPS-LZJOCLMNSA-N

Data: 2 EC50

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 2 hits for monomerid = 50260008   

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
Signal transduction protein TRAP (Staphylococcus aureus (strain Mu50 / ATCC 700699))	BDBM50260008 (CHEMBL4077031) Show SMILES O[C@@H]1[C@@H](CNC(=O)c2ccccc2Cl)OC[C@@]1(O)CN1C(=O)c2ccccc2C1=O |r| Show InChI InChI=1S/C21H19ClN2O6/c22-15-8-4-3-7-14(15)18(26)23-9-16-17(25)21(29,11-30-16)10-24-19(27)12-5-1-2-6-13(12)20(24)28/h1-8,16-17,25,29H,9-11H2,(H,23,26)/t16-,17-,21+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.63E+3	n/a	n/a	n/a	n/a
Ghent University Curated by ChEMBL					Assay Description Inhibition of methicillin-resistant Staphylococcus aureus Mu50 TRAP assessed as potentiation of vancomycin-induced antibiofilm activity treated for 4...				ACS Med Chem Lett 8: 38-42 (2017) Article DOI: 10.1021/acsmedchemlett.6b00315 BindingDB Entry DOI: 10.7270/Q2RR21QM
					More data for this Ligand-Target Pair
Signal transduction protein TRAP (Staphylococcus aureus (strain Mu50 / ATCC 700699))	BDBM50260008 (CHEMBL4077031) Show SMILES O[C@@H]1[C@@H](CNC(=O)c2ccccc2Cl)OC[C@@]1(O)CN1C(=O)c2ccccc2C1=O |r| Show InChI InChI=1S/C21H19ClN2O6/c22-15-8-4-3-7-14(15)18(26)23-9-16-17(25)21(29,11-30-16)10-24-19(27)12-5-1-2-6-13(12)20(24)28/h1-8,16-17,25,29H,9-11H2,(H,23,26)/t16-,17-,21+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3.90E+4	n/a	n/a	n/a	n/a
Ghent University Curated by ChEMBL					Assay Description Inhibition of methicillin-resistant Staphylococcus aureus Mu50 TRAP assessed as potentiation of vancomycin-induced antibiofilm activity cotreated wit...				ACS Med Chem Lett 8: 38-42 (2017) Article DOI: 10.1021/acsmedchemlett.6b00315 BindingDB Entry DOI: 10.7270/Q2RR21QM
					More data for this Ligand-Target Pair