BDBM50349550 CHEMBL1808895

SMILES: Cc1cc(ccn1)-c1cc(C)c(cn1)C1CCCN1C(=O)c1cnccn1

InChI Key: InChIKey=CASOIDDYMKIXSH-UHFFFAOYSA-N

Data: 1 IC50

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 = 50349550   

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))	BDBM50349550 (CHEMBL1808895) Show SMILES Cc1cc(ccn1)-c1cc(C)c(cn1)C1CCCN1C(=O)c1cnccn1 Show InChI InChI=1S/C21H21N5O/c1-14-10-18(16-5-6-23-15(2)11-16)25-12-17(14)20-4-3-9-26(20)21(27)19-13-22-7-8-24-19/h5-8,10-13,20H,3-4,9H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	370	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA, Inc. Curated by ChEMBL					Assay Description Negative allosteric modulation of human mGlu5 receptor expressed in HEK293 cells assessed as inhibition of glutamate-induced calcium mobilization aft...				Bioorg Med Chem Lett 21: 4891-9 (2011) Article DOI: 10.1016/j.bmcl.2011.06.014 BindingDB Entry DOI: 10.7270/Q2CN748G
					More data for this Ligand-Target Pair