BDBM50392393 CHEMBL2151634

SMILES: Cc1cccc(c1)-c1noc(n1)[C@@H]1CCN1C(=O)c1ccc(cc1)C#N

InChI Key: InChIKey=KISVEYIIDMTDBM-KRWDZBQOSA-N

Data: 1 IC50  1 EC50

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 2 hits for monomerid = 50392393   

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))	BDBM50392393 (CHEMBL2151634) Show SMILES Cc1cccc(c1)-c1noc(n1)[C@@H]1CCN1C(=O)c1ccc(cc1)C#N |r| Show InChI InChI=1S/C20H16N4O2/c1-13-3-2-4-16(11-13)18-22-19(26-23-18)17-9-10-24(17)20(25)15-7-5-14(12-21)6-8-15/h2-8,11,17H,9-10H2,1H3/t17-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Lundbeck Research USA Curated by ChEMBL					Assay Description Negative allosteric modulation of human mGluR5 expressed in recombinant HEK293 cells by FLIPR assay				Bioorg Med Chem Lett 22: 6469-74 (2012) Article DOI: 10.1016/j.bmcl.2012.08.044 BindingDB Entry DOI: 10.7270/Q23F4QR3
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 5 (Homo sapiens (Human))	BDBM50392393 (CHEMBL2151634) Show SMILES Cc1cccc(c1)-c1noc(n1)[C@@H]1CCN1C(=O)c1ccc(cc1)C#N |r| Show InChI InChI=1S/C20H16N4O2/c1-13-3-2-4-16(11-13)18-22-19(26-23-18)17-9-10-24(17)20(25)15-7-5-14(12-21)6-8-15/h2-8,11,17H,9-10H2,1H3/t17-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
Lundbeck Research USA Curated by ChEMBL					Assay Description Positive allosteric modulation of human mGluR5 expressed in recombinant HEK293 cells by FLIPR assay				Bioorg Med Chem Lett 22: 6469-74 (2012) Article DOI: 10.1016/j.bmcl.2012.08.044 BindingDB Entry DOI: 10.7270/Q23F4QR3
					More data for this Ligand-Target Pair