BDBM18086 2-({[2-(benzyloxy)phenyl]methyl}amino)-1-(3-iodophenyl)ethan-1-ol::ethanolamine, 23

SMILES: OC(CNCc1ccccc1OCc1ccccc1)c1cccc(I)c1

InChI Key: InChIKey=IFXGTDNEENMFTO-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 18086   

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
tRNA synthetase (PheRS) (Staphylococcus aureus)	BDBM18086 (2-({[2-(benzyloxy)phenyl]methyl}amino)-1-(3-iodoph...) Show SMILES OC(CNCc1ccccc1OCc1ccccc1)c1cccc(I)c1 Show InChI InChI=1S/C22H22INO2/c23-20-11-6-10-18(13-20)21(25)15-24-14-19-9-4-5-12-22(19)26-16-17-7-2-1-3-8-17/h1-13,21,24-25H,14-16H2	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair