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SMILES: N#Cc1cccc(c1)-c1cc(ncn1)-c1ccncn1

InChI Key: InChIKey=AMKOCUCZZIHADS-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50113481   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50113481 (CHEMBL3603928) Show SMILES N#Cc1cccc(c1)-c1cc(ncn1)-c1ccncn1 Show InChI InChI=1S/C15H9N5/c16-8-11-2-1-3-12(6-11)14-7-15(20-10-19-14)13-4-5-17-9-18-13/h1-7,9-10H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Heptares Therapeutics Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-M-MPEP from human mGlu5 receptor expressed in HEK293 cells after 90 mins by scintillation spectroscopy analysis				J Med Chem 58: 6653-64 (2015) BindingDB Entry DOI: 10.7270/Q2H70HMZ
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 5 (Homo sapiens (Human))	BDBM50113481 (CHEMBL3603928) Show SMILES N#Cc1cccc(c1)-c1cc(ncn1)-c1ccncn1 Show InChI InChI=1S/C15H9N5/c16-8-11-2-1-3-12(6-11)14-7-15(20-10-19-14)13-4-5-17-9-18-13/h1-7,9-10H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
Heptares Therapeutics Ltd. Curated by ChEMBL					Assay Description Negative allosteric modulation at human mGlu5 receptor expressed in HEK293 cells assessed as inhibition of L-quisqualic acid-induced inositol phospha...				J Med Chem 58: 6653-64 (2015) BindingDB Entry DOI: 10.7270/Q2H70HMZ
					More data for this Ligand-Target Pair