BDBM50259996 CHEMBL4085383

SMILES: O[C@@H]1[C@@H](CNC(=O)c2ccccc2)OC[C@@]1(O)CNC(=O)c1ccccc1Cl

InChI Key: InChIKey=GXUIAUGPTVLXNJ-HLIPFELVSA-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 = 50259996   

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))	BDBM50259996 (CHEMBL4085383) Show SMILES O[C@@H]1[C@@H](CNC(=O)c2ccccc2)OC[C@@]1(O)CNC(=O)c1ccccc1Cl |r| Show InChI InChI=1S/C20H21ClN2O5/c21-15-9-5-4-8-14(15)19(26)23-11-20(27)12-28-16(17(20)24)10-22-18(25)13-6-2-1-3-7-13/h1-9,16-17,24,27H,10-12H2,(H,22,25)(H,23,26)/t16-,17-,20+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.50E+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
Signal transduction protein TRAP (Staphylococcus aureus (strain Mu50 / ATCC 700699))	BDBM50259996 (CHEMBL4085383) Show SMILES O[C@@H]1[C@@H](CNC(=O)c2ccccc2)OC[C@@]1(O)CNC(=O)c1ccccc1Cl |r| Show InChI InChI=1S/C20H21ClN2O5/c21-15-9-5-4-8-14(15)19(26)23-11-20(27)12-28-16(17(20)24)10-22-18(25)13-6-2-1-3-7-13/h1-9,16-17,24,27H,10-12H2,(H,22,25)(H,23,26)/t16-,17-,20+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	5.58E+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