BDBM552999 (R)-N-(4-fluoro-2-(4- methylpiperazin-1-yl)-5- (5-(((tetrahydrofuran-3- yl)amino)methyl)pyridin- 3-yl)phenyl)-6-oxo-4- (trifluoromethyl)-1,6- dihydropyridine-3- carboxamide::US11319299, Example 49

SMILES CN1CCN(c2cc(F)c(-c3cncc(CNC4CCOC4)c3)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)CC1

InChI Key InChIKey=MLWGWBABICPOMW-UHFFFAOYSA-N

Data  1 IC50  1 Kd

  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 = 552999   

TargetWD repeat-containing protein 5(Human)
Propellon Therapeutics

US Patent
LigandChemical structure of BindingDB Monomer ID 552999BDBM552999((R)-N-(4-fluoro-2-(4- methylpiperazin-1-yl)-5- (5-...)
Affinity DataKd:  14nMAssay Description:Exemplary compounds of the application were dissolved in 100% DMSO at 10 mM, assayed fresh, and then stored at −20° C. for repeat studies and o...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/7/2022
Entry Details
US Patent

TargetMLL1-WRAD2 complex(Human)
Propellon Therapeutics

US Patent
LigandChemical structure of BindingDB Monomer ID 552999BDBM552999((R)-N-(4-fluoro-2-(4- methylpiperazin-1-yl)-5- (5-...)
Affinity DataIC50: 1.77E+4nMAssay Description:Compound potency was assessed through incorporation of 3H-SAM into oligonucleosomes purified from HeLa cells. Specifically, recombinant human MLL1 (a...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/7/2022
Entry Details
US Patent