Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 326.3 BDBM50446083

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
P2X purinoceptor 4 (Homo sapiens (Human))	BDBM50446083 (CHEMBL3103402) Show SMILES O=C(NCc1ccccc1)N1c2ccccc2C=Cc2ccccc12 |c:19| Show InChI InChI=1S/C22H18N2O/c25-22(23-16-17-8-2-1-3-9-17)24-20-12-6-4-10-18(20)14-15-19-11-5-7-13-21(19)24/h1-15H,16H2,(H,23,25)	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.89E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bonn Curated by ChEMBL					Assay Description Antagonist activity at human P2X4 receptor expressed in human 1321N1 cells assessed as inhibition of ATP-induced cytosolic calcium influx preincubate...				Bioorg Med Chem 22: 1077-88 (2014) Article DOI: 10.1016/j.bmc.2013.12.035 BindingDB Entry DOI: 10.7270/Q21R6S09
					More data for this Ligand-Target Pair