BDBM300229 US9593127, Example 3::ethyl 3-[2-(3- chlorophenyl)ethynyl]- 3a,4,5,6a- tetrahydropyrrolo[3,2- d]isoxazole-6-carboxylate

SMILES CCOC(=O)N1CCC2C1ON=C2C#Cc1cccc(Cl)c1

InChI Key InChIKey=YFQBRJZBGIESKE-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 300229   

TargetMetabotropic glutamate receptor 5(Homo sapiens (Human))
Recordati Ireland

US Patent
LigandPNGBDBM300229(US9593127, Example 3 | ethyl 3-[2-(3- chlorophenyl...)
Affinity DataIC50:  81.5nMAssay Description:Affinity at transmembrane glutamate metabotropic mGluR5 receptor subtypes was evaluated according to the methods of Anderson (Anderson et al., J Phar...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent