BDBM66798 4-{2-[(2S)-2-Methylazetidin-1-yl]-6-(trifluoromethyl)pyrimidin-4-yl}benzoic acid::US12479829, Example 1

SMILES C[C@H]1CCN1c1nc(-c2ccc(C(=O)O)cc2)cc(C(F)(F)F)n1

InChI Key InChIKey=WCQZXULHSJMWNH-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 66798   

TargetIsoform A of Ketohexokinase (Peripheral)(Human)
Eli Lilly

US Patent
LigandChemical structure of BindingDB Monomer ID 66798BDBM66798(4-{2-[(2S)-2-Methylazetidin-1-yl]-6-(trifluorometh...)
Affinity DataIC50: 21.5nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/6/2026
Entry Details
US Patent

TargetKetohexokinase(Human)
Eli Lilly

US Patent
LigandChemical structure of BindingDB Monomer ID 66798BDBM66798(4-{2-[(2S)-2-Methylazetidin-1-yl]-6-(trifluorometh...)
Affinity DataIC50: 22.6nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/6/2026
Entry Details
US Patent