Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Metabotropic glutamate receptor 5' and Ligand = 'BDBM107249'   

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))	BDBM107249 (US8598345, 201 | US8598345, Table 1-35/2-5) Show SMILES CN(c1cncnc1)c1ccnc(c1)C(=O)Nc1nc(C)cs1 Show InChI InChI=1S/C15H14N6OS/c1-10-8-23-15(19-10)20-14(22)13-5-11(3-4-18-13)21(2)12-6-16-9-17-7-12/h3-9H,1-2H3,(H,19,20,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Vanderbilt University US Patent					Assay Description mGluR5 activity was determined in a cell-based assay.				US Patent US8598345 (2013) BindingDB Entry DOI: 10.7270/Q2RR1WX8
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 5 (Rattus norvegicus (Rat))	BDBM107249 (US8598345, 201 | US8598345, Table 1-35/2-5) Show SMILES CN(c1cncnc1)c1ccnc(c1)C(=O)Nc1nc(C)cs1 Show InChI InChI=1S/C15H14N6OS/c1-10-8-23-15(19-10)20-14(22)13-5-11(3-4-18-13)21(2)12-6-16-9-17-7-12/h3-9H,1-2H3,(H,19,20,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.93E+3	n/a	n/a	n/a	n/a	n/a	n/a
Vanderbilt University US Patent					Assay Description mGluR5 activity was determined in a cell-based assay.				US Patent US8598345 (2013) BindingDB Entry DOI: 10.7270/Q2RR1WX8
					More data for this Ligand-Target Pair