BDBM50414310 CHEMBL563255

SMILES: OCCn1ccc2c(NC(=O)Cc3ccc(c(F)c3)C(F)(F)F)c(Cl)ccc2c1=O

InChI Key: InChIKey=ZXOKHTSAKAOOLZ-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 = 50414310   

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
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM50414310 (CHEMBL563255) Show SMILES OCCn1ccc2c(NC(=O)Cc3ccc(c(F)c3)C(F)(F)F)c(Cl)ccc2c1=O Show InChI InChI=1S/C20H15ClF4N2O3/c21-15-4-2-13-12(5-6-27(7-8-28)19(13)30)18(15)26-17(29)10-11-1-3-14(16(22)9-11)20(23,24)25/h1-6,9,28H,7-8,10H2,(H,26,29)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.31	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Antagonist activity at P2X7 receptor in human THP1 cells assessed as inhibition of BzATP-induced ethidium uptake				J Med Chem 52: 3123-41 (2009) Article DOI: 10.1021/jm801528x BindingDB Entry DOI: 10.7270/Q2251KDR
					More data for this Ligand-Target Pair