BDBM50222402 CHEMBL424070

SMILES: [O-][N+](=O)c1cccc(c1)-c1ccc(OCC(CCc2ccncc2)N2CCCC2=O)cc1

InChI Key: InChIKey=DNFYUGQOSDLSNQ-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 = 50222402   

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))	BDBM50222402 (CHEMBL424070) Show SMILES [O-][N+](=O)c1cccc(c1)-c1ccc(OCC(CCc2ccncc2)N2CCCC2=O)cc1 Show InChI InChI=1S/C25H25N3O4/c29-25-5-2-16-27(25)23(9-6-19-12-14-26-15-13-19)18-32-24-10-7-20(8-11-24)21-3-1-4-22(17-21)28(30)31/h1,3-4,7-8,10-15,17,23H,2,5-6,9,16,18H2	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description In vitro antagonism of P2X 7 receptor in THP-1 (human pre-monocytic) cells.				Bioorg Med Chem Lett 13: 4043-6 (2003) BindingDB Entry DOI: 10.7270/Q2930VCQ
					More data for this Ligand-Target Pair