BDBM50524488 CHEMBL4589188

SMILES c1cc2c(nc1)nc([nH]2)N

InChI Key InChIKey=KXQPVJRJUJJWQJ-UHFFFAOYSA-N

Data  2 IC50  1 Kd

PDB links: 8 PDB IDs match this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50524488   

TargetBeta-secretase 1(Human)
University of Zurich

Curated by ChEMBL
LigandPNGBDBM50524488(CHEMBL4589188)
Affinity DataIC50: 2.00E+5nMAssay Description:Inhibition of BACE1 (unknown origin) using HiLyte Fluo488/QXL-520 as substrate by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed
TargetOxidized purine nucleoside triphosphate hydrolase(Human)
University of Zurich

Curated by ChEMBL
LigandPNGBDBM50524488(CHEMBL4589188)
Affinity DataKd:  1.30E+3nMAssay Description:Binding affinity to recombinant His-tagged MTH1 (unknown origin) expressed in Escherichia coli BL21(DE3) assessed as dissociation constant by isother...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetOxidized purine nucleoside triphosphate hydrolase(Human)
University of Zurich

Curated by ChEMBL
LigandPNGBDBM50524488(CHEMBL4589188)
Affinity DataIC50: 1.10E+3nMAssay Description:Inhibition of recombinant His-tagged MTH1 (unknown origin) expressed in Escherichia coli BL21(DE3) cells using dGTP as substrate incubated for 15 min...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMedPDB3D3D Structure (crystal)