BDBM50318017 2-chloro-5-(5-fluoropyrimidin-2-yl)-N-((1-hydroxycyclopentyl)methyl)benzamide::CHEMBL1098099

SMILES: OC1(CNC(=O)c2cc(ccc2Cl)-c2ncc(F)cn2)CCCC1

InChI Key: InChIKey=LYJIEJROHPBWSQ-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 = 50318017   

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))	BDBM50318017 (2-chloro-5-(5-fluoropyrimidin-2-yl)-N-((1-hydroxyc...) Show SMILES OC1(CNC(=O)c2cc(ccc2Cl)-c2ncc(F)cn2)CCCC1 Show InChI InChI=1S/C17H17ClFN3O2/c18-14-4-3-11(15-20-8-12(19)9-21-15)7-13(14)16(23)22-10-17(24)5-1-2-6-17/h3-4,7-9,24H,1-2,5-6,10H2,(H,22,23)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	449	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer St. Louis Research Laboratories Curated by ChEMBL					Assay Description Antagonist activity at human P2X7R expressed in HEK293 cells assessed as inhibition of ATP-induced YO-PRO-1 uptake				Bioorg Med Chem Lett 20: 3107-11 (2010) Article DOI: 10.1016/j.bmcl.2010.03.094 BindingDB Entry DOI: 10.7270/Q2D50N4Q
					More data for this Ligand-Target Pair