Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'P2X purinoceptor 7' and Ligand = 'BDBM50374471'   

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 7 (Homo sapiens (Human))	BDBM50374471 (CHEMBL257275) Show SMILES COc1ccc(cc1OC)C(=O)N1CCN(CC1c1ccccc1)C(NC#N)=Nc1ccccc1C |w:28.31| Show InChI InChI=1S/C28H29N5O3/c1-20-9-7-8-12-23(20)31-28(30-19-29)32-15-16-33(24(18-32)21-10-5-4-6-11-21)27(34)22-13-14-25(35-2)26(17-22)36-3/h4-14,17,24H,15-16,18H2,1-3H3,(H,30,31)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	94	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Bioresearch Center Curated by ChEMBL					Assay Description Antagonist activity at human recombinant P2X7 receptor assessed as inhibition of calcium flux by FLIPR assay				Bioorg Med Chem Lett 18: 2093-6 (2008) Article DOI: 10.1016/j.bmcl.2008.01.094 BindingDB Entry DOI: 10.7270/Q2HH6KXV
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM50374471 (CHEMBL257275) Show SMILES COc1ccc(cc1OC)C(=O)N1CCN(CC1c1ccccc1)C(NC#N)=Nc1ccccc1C |w:28.31| Show InChI InChI=1S/C28H29N5O3/c1-20-9-7-8-12-23(20)31-28(30-19-29)32-15-16-33(24(18-32)21-10-5-4-6-11-21)27(34)22-13-14-25(35-2)26(17-22)36-3/h4-14,17,24H,15-16,18H2,1-3H3,(H,30,31)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	290	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Bioresearch Center Curated by ChEMBL					Assay Description Antagonist activity at rat recombinant P2X7 receptor assessed as inhibition of calcium flux by FLIPR assay				Bioorg Med Chem Lett 18: 2093-6 (2008) Article DOI: 10.1016/j.bmcl.2008.01.094 BindingDB Entry DOI: 10.7270/Q2HH6KXV
					More data for this Ligand-Target Pair