BDBM50113465 CHEMBL3603912

SMILES: NC(=O)c1cc(F)cc(c1)-c1cc(ncn1)-n1cccn1

InChI Key: InChIKey=JEOLLIJNXNLLEV-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50113465   

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))	BDBM50113465 (CHEMBL3603912) Show SMILES NC(=O)c1cc(F)cc(c1)-c1cc(ncn1)-n1cccn1 Show InChI InChI=1S/C14H10FN5O/c15-11-5-9(4-10(6-11)14(16)21)12-7-13(18-8-17-12)20-3-1-2-19-20/h1-8H,(H2,16,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	<6.31E+4	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