BDBM50318008 2-chloro-5-(6-cyanopyridin-2-yl)-N-((1-hydroxycycloheptyl)methyl)benzamide::CHEMBL1096699

SMILES: OC1(CNC(=O)c2cc(ccc2Cl)-c2cccc(n2)C#N)CCCCCC1

InChI Key: InChIKey=CTINQCBBNYRHAA-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 = 50318008   

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))	BDBM50318008 (2-chloro-5-(6-cyanopyridin-2-yl)-N-((1-hydroxycycl...) Show SMILES OC1(CNC(=O)c2cc(ccc2Cl)-c2cccc(n2)C#N)CCCCCC1 Show InChI InChI=1S/C21H22ClN3O2/c22-18-9-8-15(19-7-5-6-16(13-23)25-19)12-17(18)20(26)24-14-21(27)10-3-1-2-4-11-21/h5-9,12,27H,1-4,10-11,14H2,(H,24,26)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	232	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