BDBM571412 US11440922, Example 31::ethyl (4E)-4-[3-(4- cyanopyridin-2-yl)prop-2- yn-1-ylidene]-3,3- dimethylpiperidine-1- carboxylate

SMILES CCOC(=O)N1CC\C(=C/C#Cc2cc(ccn2)C#N)C(C)(C)C1

InChI Key InChIKey=GSSIGLHMZBXBRJ-OMCISZLKSA-N

Data  1 KI  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 571412   

TargetMetabotropic glutamate receptor 5(Homo sapiens (Human))
Recordati Industria Chimica E Farmacentica

US Patent
LigandPNGBDBM571412(US11440922, Example 31 | ethyl (4E)-4-[3-(4- cyano...)
Affinity DataKi:  2.93nMAssay Description:Affinity at transmembrane glutamate metabotropic cloned human mGluR5 receptor was evaluated according to the methods of Anderson (Anderson et al., J ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent
TargetMetabotropic glutamate receptor 5(Homo sapiens (Human))
Recordati Industria Chimica E Farmacentica

US Patent
LigandPNGBDBM571412(US11440922, Example 31 | ethyl (4E)-4-[3-(4- cyano...)
Affinity DataIC50:  13.5nMAssay Description:Cells were seeded into black-walled, clear-bottom, 96-well plates at a density of 80000 cell/well, in RPMI (without Phenol Red, without L-glutamine; ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent