BDBM26494 N-{2-methyl-5-[(6-phenylpyrimidin-4-yl)amino]phenyl}acetamide::aminopyrimidine, 15

SMILES: CC(=O)Nc1cc(Nc2cc(ncn2)-c2ccccc2)ccc1C

InChI Key: InChIKey=UCTUSYYVGGFOAX-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 = 26494   

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-secretase 1 (Homo sapiens (Human))	BDBM26494 (N-{2-methyl-5-[(6-phenylpyrimidin-4-yl)amino]pheny...) Show SMILES CC(=O)Nc1cc(Nc2cc(ncn2)-c2ccccc2)ccc1C Show InChI InChI=1S/C19H18N4O/c1-13-8-9-16(10-17(13)22-14(2)24)23-19-11-18(20-12-21-19)15-6-4-3-5-7-15/h3-12H,1-2H3,(H,22,24)(H,20,21,23)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>6.00E+5	n/a	n/a	n/a	n/a	4.5	22
Merck Research Laboratories					Assay Description The assay was performed using a 96-well format on a HPLC equipped with four 96-well plate holders. After the reaction was terminated, the solution wa...				Bioorg Med Chem Lett 19: 17-20 (2009) Article DOI: 10.1016/j.bmcl.2008.11.027 BindingDB Entry DOI: 10.7270/Q22J696F
					More data for this Ligand-Target Pair