BDBM578557 3-[3-(2,6- dimethyl-4- pyridyl)-5- fluoro-2- pyridyl]-3- methoxy-5,5- dimethyl-6-oxo- cyclohexene-1- carbonitrile (Enantiomer A)::US11479539, Compound 173::US11479539, Compound 77

SMILES COC1(CC(C)(C)C(=O)C(=C1)C#N)c1ncc(F)cc1-c1cc(C)nc(C)c1

InChI Key InChIKey=HMIDEMOHNGNDME-UHFFFAOYSA-N

Data  2 EC50

  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 2 hits for monomerid = 578557   

Targethek293 luciferase(HIV-1)
Medimmune

US Patent
LigandPNGBDBM578557(US11479539, Compound 77 | 3-[3-(2,6- dimethyl-4- p...)
Affinity DataEC50:  4nMAssay Description:Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/30/2022
Entry Details
US Patent

Targethek293 luciferase(HIV-1)
Medimmune

US Patent
LigandPNGBDBM578557(US11479539, Compound 77 | 3-[3-(2,6- dimethyl-4- p...)
Affinity DataEC50:  15nMAssay Description:Purpose of the AssayThe purpose of this assay is to identify small molecule inhibitors of Keap1, preventing Keap1 binding to Nrf2, and thus activatin...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/30/2022
Entry Details
US Patent