BDBM50107491 CHEMBL149644::N-(4'-Chloro-biphenyl-4-ylmethyl)-2-{2-(4-fluoro-benzylsulfanyl)-5-[2-(4-methyl-piperazin-1-yl)-pyrimidin-5-ylmethyl]-4-oxo-4H-pyrimidin-1-yl}-N-methyl-acetamide

SMILES: CN(Cc1ccc(cc1)-c1ccc(Cl)cc1)C(=O)Cn1cc(Cc2cnc(nc2)N2CCN(C)CC2)c(=O)nc1SCc1ccc(F)cc1

InChI Key: InChIKey=QACJRVCEGDIMHU-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 = 50107491   

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
LDL-associated phospholipase A2 (Homo sapiens (Human))	BDBM50107491 (CHEMBL149644 | N-(4'-Chloro-biphenyl-4-ylmethyl)-2...) Show SMILES CN(Cc1ccc(cc1)-c1ccc(Cl)cc1)C(=O)Cn1cc(Cc2cnc(nc2)N2CCN(C)CC2)c(=O)nc1SCc1ccc(F)cc1 Show InChI InChI=1S/C37H37ClFN7O2S/c1-43-15-17-45(18-16-43)36-40-20-28(21-41-36)19-31-23-46(37(42-35(31)48)49-25-27-5-13-33(39)14-6-27)24-34(47)44(2)22-26-3-7-29(8-4-26)30-9-11-32(38)12-10-30/h3-14,20-21,23H,15-19,22,24-25H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.70	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibitory activity against recombinant human Lp-PLA2 (Lp-PLA2).				Bioorg Med Chem Lett 12: 51-5 (2001) BindingDB Entry DOI: 10.7270/Q2862FR5
					More data for this Ligand-Target Pair