Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Metabotropic glutamate receptor 5' and Ligand = 'BDBM50171056'   

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
Metabotropic glutamate receptor 5 (Homo sapiens (Human))	BDBM50171056 (5'-Ethoxy-6'-(6-methyl-pyridin-2-ylamino)-[3,3']bi...) Show SMILES CCOc1cc(cnc1Nc1cccc(C)n1)-c1cccnc1C#N Show InChI InChI=1S/C19H17N5O/c1-3-25-17-10-14(15-7-5-9-21-16(15)11-20)12-22-19(17)24-18-8-4-6-13(2)23-18/h4-10,12H,3H2,1-2H3,(H,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description In vitro potency against calcium flux in Ltk cells expressing human recombinant metabotropic glutamate receptor 5 using fluorescence detection				Bioorg Med Chem Lett 15: 4350-3 (2005) Article DOI: 10.1016/j.bmcl.2005.06.059 BindingDB Entry DOI: 10.7270/Q2QZ29H0
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