BDBM291627 1-(4-(((6-amino-5-(4-(phenylamino)phenyl)pyrimidin-4-yl)amino)methyl)piperidin-1-yl)prop-2-en-1-one ::US9580449, Example A39

SMILES Nc1ncnc(NCC2CCN(CC2)C(=O)C=C)c1-c1ccc(Oc2ccccc2)cc1

InChI Key InChIKey=QUIWHXQETADMGN-UHFFFAOYSA-N

Data  1 IC50  1 EC50

  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 = 291627   

TargetADP-sugar pyrophosphatase(Human)
University of Oxford

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 291627BDBM291627(1-(4-(((6-amino-5-(4-(phenylamino)phenyl)pyrimidin...)
Affinity DataEC50: >1.00E+4nMAssay Description:Antagonist activity at N-terminal his6-tagged human recombinant NUDT5 (1 to 208 residues) expressed in Escherichia coli Rosetta (DE3) expressed in HE...More data for this Ligand-Target Pair
Ligand InfoSimilars
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetADP-sugar pyrophosphatase(Human)
University of Oxford

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 291627BDBM291627(1-(4-(((6-amino-5-(4-(phenylamino)phenyl)pyrimidin...)
Affinity DataIC50: 1.39E+4nMAssay Description:Antagonist activity at N-terminal his6-tagged human recombinant NUDT5 (1 to 208 residues) expressed in Escherichia coli Rosetta (DE3) using ADP as su...More data for this Ligand-Target Pair
Ligand InfoSimilars
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed