BDBM50256603 13-Allyl-9,10-dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinolin-7-ylium iodide::CHEMBL475567

SMILES: COc1ccc2c(CC=C)c3-c4cc5OCOc5cc4CC[n+]3cc2c1OC

InChI Key: InChIKey=JWJSTOFHGUFXFO-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 = 50256603   

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))	BDBM50256603 (13-Allyl-9,10-dimethoxy-5,6-dihydro-[1,3]dioxolo[4...) Show SMILES COc1ccc2c(CC=C)c3-c4cc5OCOc5cc4CC[n+]3cc2c1OC Show InChI InChI=1S/C23H22NO4/c1-4-5-16-15-6-7-19(25-2)23(26-3)18(15)12-24-9-8-14-10-20-21(28-13-27-20)11-17(14)22(16)24/h4,6-7,10-12H,1,5,8-9,13H2,2-3H3/q+1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	440	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Science and Technology (GIST) Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in HEK293 cells assessed as inhibition of BzATP-induced fluorescent ethidium accumulation				Bioorg Med Chem Lett 19: 954-8 (2009) Article DOI: 10.1016/j.bmcl.2008.11.088 BindingDB Entry DOI: 10.7270/Q23T9H3S
					More data for this Ligand-Target Pair