Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Metabotropic glutamate receptor 5' and Ligand = 'BDBM107216'   

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 (Rattus norvegicus (Rat))	BDBM107216 (US8598345, 197 | US8598345, Table 1-2/2-1) Show SMILES Clc1cccc(NC(=O)c2cc(Oc3cccnc3)ccn2)c1 Show InChI InChI=1S/C17H12ClN3O2/c18-12-3-1-4-13(9-12)21-17(22)16-10-14(6-8-20-16)23-15-5-2-7-19-11-15/h1-11H,(H,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	358	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 (Homo sapiens (Human))	BDBM107216 (US8598345, 197 | US8598345, Table 1-2/2-1) Show SMILES Clc1cccc(NC(=O)c2cc(Oc3cccnc3)ccn2)c1 Show InChI InChI=1S/C17H12ClN3O2/c18-12-3-1-4-13(9-12)21-17(22)16-10-14(6-8-20-16)23-15-5-2-7-19-11-15/h1-11H,(H,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	390	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