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SMILES: COc1ncc(Cc2cn(CCCC(=O)NCc3ccc(cc3)-c3ccc(Cl)cc3)c(SCc3ccc(F)cc3)nc2=O)cn1

InChI Key: InChIKey=HMXGSDCSSJMFAU-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50107504   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Platelet-activating factor acetylhydrolase


(Homo sapiens (Human))		BDBM50107504
PNG
(CHEMBL154817 | N-(4'-Chloro-biphenyl-4-ylmethyl)-4...)
Show SMILES COc1ncc(Cc2cn(CCCC(=O)NCc3ccc(cc3)-c3ccc(Cl)cc3)c(SCc3ccc(F)cc3)nc2=O)cn1
Show InChI InChI=1S/C34H31ClFN5O3S/c1-44-33-38-19-25(20-39-33)17-28-21-41(34(40-32(28)43)45-22-24-6-14-30(36)15-7-24)16-2-3-31(42)37-18-23-4-8-26(9-5-23)27-10-12-29(35)13-11-27/h4-15,19-21H,2-3,16-18,22H2,1H3,(H,37,42)
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n/an/a 4n/an/an/an/an/an/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