BDBM50382403 CHEMBL2022170

SMILES: CN1CCC(=O)N=C1NC(=S)Nc1cccc(Cl)c1

InChI Key: InChIKey=YXIYNYHJKIHTJY-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 = 50382403   

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))	BDBM50382403 (CHEMBL2022170) Show SMILES CN1CCC(=O)N=C1NC(=S)Nc1cccc(Cl)c1 |c:6| Show InChI InChI=1S/C12H13ClN4OS/c1-17-6-5-10(18)15-11(17)16-12(19)14-9-4-2-3-8(13)7-9/h2-4,7H,5-6H2,1H3,(H2,14,15,16,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	570	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Antagonist activity at human mGluR5 expressed in CHO-K1 cells assessed as inhibition of glutamate-induced intracellular calcium mobilization				ACS Med Chem Lett 2: 882-884 (2011) Article DOI: 10.1021/ml200162f BindingDB Entry DOI: 10.7270/Q2XW4KT8
					More data for this Ligand-Target Pair