BDBM450402 2-[6-(4- Acetylpiperazin-1- yl)-4- oxoquinazolin-3- yl]acetic acid (intermediate A-2) and [4-(trifluoro- methoxy)phenyl] methanamine ([CAS RN 93919-56-3])::US10676446, Example 20

SMILES CC(=O)N1CCN(CC1)c1ccc2ncn(CC(=O)NCc3ccc(OC(F)(F)F)cc3)c(=O)c2c1

InChI Key InChIKey=XJHZPQFZIBOBJC-UHFFFAOYSA-N

Data  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 1 hit for monomerid = 450402   

TargetEctonucleotide pyrophosphatase/phosphodiesterase family member 2(Homo sapiens (Human))
Hoffmann-La Roche

US Patent
LigandPNGBDBM450402(2-[6-(4- Acetylpiperazin-1- yl)-4- oxoquinazolin-3...)
Affinity DataIC50:  5nMAssay Description:ATX inhibition was measured by a fluorescence quenching assay using a specifically labeled substrate analogue (MR121 substrate). To obtain this MR121...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent