BDBM518441 1-[(2S,5R)-2,5-Dimethylpiperazin-1-yl]- 2-[4-[2-[(2S)-2-methylazetidin-1-yl]-6- (trifluoromethyl)pyrimidin-4-yl]pyrazol- 1-yl]ethanone::US11124500, Example 32

SMILES C[C@H]1CCN1c1nc(cc(n1)C(F)(F)F)-c1cnn(CC(=O)N2C[C@@H](C)NC[C@@H]2C)c1

InChI Key InChIKey=DTGFVGNGXJPZEE-UHFFFAOYSA-N

Data  2 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 = 518441   

TargetKetohexokinase(Human)
Eli Lilly

US Patent
LigandPNGBDBM518441(US11124500, Example 32 | 1-[(2S,5R)-2,5-Dimethylpi...)
Affinity DataIC50: 13.3nMAssay Description:The intrinsic potency for inhibition of KHK C or A activity may be measured using an enzymatic assay which measures the production of FIP. Compounds ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/26/2022
Entry Details
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TargetIsoform A of Ketohexokinase (Peripheral)(Human)
Eli Lilly

US Patent
LigandPNGBDBM518441(US11124500, Example 32 | 1-[(2S,5R)-2,5-Dimethylpi...)
Affinity DataIC50: 41.5nMAssay Description:The intrinsic potency for inhibition of KHK C or A activity may be measured using an enzymatic assay which measures the production of FIP. Compounds ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/26/2022
Entry Details
Go to US Patent