BDBM50605479 CHEMBL5177760::US20250154115, Compound 9

SMILES CN(C)C(=O)\C=C\c1ccc2noc(-c3ccccc3)c2c1

InChI Key InChIKey=FNTWBGGJBFTZMG-UHFFFAOYSA-N

Data  6 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50605479   

TargetInositol hexakisphosphate kinase 1(Human)
University of North Carolina at Chapel Hill

Curated by ChEMBL
LigandPNGBDBM50605479(CHEMBL5177760 | US20250154115, Compound 9)
Affinity DataIC50: 2.95E+4nMAssay Description:Inhibition of N-terminal 6His-MBP-tagged recombinant human IP6K1 expressed in Escherichia coli assessed as inorganic phosphate release using InsP6 as...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/25/2023
Entry Details
PubMed
TargetInositol hexakisphosphate kinase 2(Human)
University of North Carolina at Chapel Hill

Curated by ChEMBL
LigandPNGBDBM50605479(CHEMBL5177760 | US20250154115, Compound 9)
Affinity DataIC50: 4.03E+4nMAssay Description:Inhibition of N-terminal 6His-tagged/TEV cleavage site fused recombinant human IP6K2 expressed in Escherichia coli assessed as inorganic phosphate re...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/25/2023
Entry Details
PubMed
TargetInositol hexakisphosphate kinase 3(Human)
University of North Carolina at Chapel Hill

Curated by ChEMBL
LigandPNGBDBM50605479(CHEMBL5177760 | US20250154115, Compound 9)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of N-terminal 6His-sumo-tagged recombinant human IP6K3 expressed in Escherichia coli assessed as inorganic phosphate release using InsP6 a...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/25/2023
Entry Details
PubMed
TargetInositol hexakisphosphate kinase 1(Human)
University of North Carolina at Chapel Hill

Curated by ChEMBL
LigandPNGBDBM50605479(CHEMBL5177760 | US20250154115, Compound 9)
Affinity DataIC50: 5.05E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/15/2025
Entry Details
Go to US Patent

TargetInositol hexakisphosphate kinase 2(Human)
University of North Carolina at Chapel Hill

Curated by ChEMBL
LigandPNGBDBM50605479(CHEMBL5177760 | US20250154115, Compound 9)
Affinity DataIC50: 5.05E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/15/2025
Entry Details
Go to US Patent

TargetInositol hexakisphosphate kinase 3(Human)
University of North Carolina at Chapel Hill

Curated by ChEMBL
LigandPNGBDBM50605479(CHEMBL5177760 | US20250154115, Compound 9)
Affinity DataIC50: 100nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/15/2025
Entry Details
Go to US Patent