BDBM50433660 CHEMBL2380955

SMILES: CC(N(C)CCN(C)C)c1nnc(Cn2c3CCCc3c(=O)nc2SCc2ccc(F)cc2)n1Cc1ccc(cc1)-c1ccc(cc1)C(F)(F)F

InChI Key: InChIKey=TVYKSXYNPUZARC-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 = 50433660   

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))	BDBM50433660 (CHEMBL2380955) Show SMILES CC(N(C)CCN(C)C)c1nnc(Cn2c3CCCc3c(=O)nc2SCc2ccc(F)cc2)n1Cc1ccc(cc1)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C38H41F4N7OS/c1-25(47(4)21-20-46(2)3)35-45-44-34(49(35)22-26-8-12-28(13-9-26)29-14-16-30(17-15-29)38(40,41)42)23-48-33-7-5-6-32(33)36(50)43-37(48)51-24-27-10-18-31(39)19-11-27/h8-19,25H,5-7,20-24H2,1-4H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.810	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of recombinant human Lp-PLA2 using [3H]PAF as substrate at 10 nM incubated for 5 mins prior to substrate addition measured after 10 mins b...				Bioorg Med Chem Lett 23: 2897-901 (2013) Article DOI: 10.1016/j.bmcl.2013.03.062 BindingDB Entry DOI: 10.7270/Q2KW5HFS
					More data for this Ligand-Target Pair