BDBM50443060 CHEMBL3087215

SMILES: COC(=O)N1[C@H]2CC[C@@H]1C[C@](O)(C2)C#Cc1ccc(F)cc1

InChI Key: InChIKey=ZVNQKNXRZVGRGJ-QLPKVWCKSA-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 = 50443060   

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))	BDBM50443060 (CHEMBL3087215) Show SMILES COC(=O)N1[C@H]2CC[C@@H]1C[C@](O)(C2)C#Cc1ccc(F)cc1 |r,TLB:2:4:9.10.12:6.7| Show InChI InChI=1S/C17H18FNO3/c1-22-16(20)19-14-6-7-15(19)11-17(21,10-14)9-8-12-2-4-13(18)5-3-12/h2-5,14-15,21H,6-7,10-11H2,1H3/t14-,15+,17+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.19E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merz Pharmaceuticals GmbH Curated by ChEMBL					Assay Description Negative allosteric modulation of human mGlu5 receptor expressed in CHO cells assessed as inhibition of L-quisqualate-induced intracellular calcium m...				Bioorg Med Chem Lett 23: 6370-6 (2013) Article DOI: 10.1016/j.bmcl.2013.09.059 BindingDB Entry DOI: 10.7270/Q2W37XRD
					More data for this Ligand-Target Pair