Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Metabotropic glutamate receptor 5' and Ligand = 'BDBM50392385'   

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))	BDBM50392385 (CHEMBL2151627) Show SMILES CC1CN(CC(C)O1)C(=O)N1CC(C1)c1nc(no1)-c1cccc(Cl)c1 Show InChI InChI=1S/C18H21ClN4O3/c1-11-7-22(8-12(2)25-11)18(24)23-9-14(10-23)17-20-16(21-26-17)13-4-3-5-15(19)6-13/h3-6,11-12,14H,7-10H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	990	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA Curated by ChEMBL					Assay Description Negative allosteric modulation of human mGluR5 expressed in recombinant HEK293 cells by FLIPR assay				Bioorg Med Chem Lett 22: 6469-74 (2012) Article DOI: 10.1016/j.bmcl.2012.08.044 BindingDB Entry DOI: 10.7270/Q23F4QR3
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 5 (Homo sapiens (Human))	BDBM50392385 (CHEMBL2151627) Show SMILES CC1CN(CC(C)O1)C(=O)N1CC(C1)c1nc(no1)-c1cccc(Cl)c1 Show InChI InChI=1S/C18H21ClN4O3/c1-11-7-22(8-12(2)25-11)18(24)23-9-14(10-23)17-20-16(21-26-17)13-4-3-5-15(19)6-13/h3-6,11-12,14H,7-10H2,1-2H3	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	>1.00E+4	n/a	n/a	n/a	n/a
Lundbeck Research USA Curated by ChEMBL					Assay Description Positive allosteric modulation of human mGluR5 expressed in recombinant HEK293 cells by FLIPR assay				Bioorg Med Chem Lett 22: 6469-74 (2012) Article DOI: 10.1016/j.bmcl.2012.08.044 BindingDB Entry DOI: 10.7270/Q23F4QR3
					More data for this Ligand-Target Pair