Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Metabotropic glutamate receptor 5' and Ligand = 'BDBM50169618'   

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))	BDBM50169618 (CHEMBL3806226) Show SMILES Cn1c2nc(ccc2n(CC(C)(C)C)c1=O)N1CC2CCC1CN2 Show InChI InChI=1S/C18H27N5O/c1-18(2,3)11-23-14-7-8-15(20-16(14)21(4)17(23)24)22-10-12-5-6-13(22)9-19-12/h7-8,12-13,19H,5-6,9-11H2,1-4H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Positive allosteric modulation of mGlu5 receptor (unknown origin)				ACS Med Chem Lett 7: 312-7 (2016) Article DOI: 10.1021/acsmedchemlett.5b00459 BindingDB Entry DOI: 10.7270/Q2W95C3K
					More data for this Ligand-Target Pair