BDBM561992 BDBM50537618::US11396496, Compound B0

SMILES COc1ccc(cc1)S(=O)(=O)N(CC(O)=O)c1ncc(N(CC(F)(F)F)S(=O)(=O)c2ccc(OC)cc2)c2ccccc12

InChI Key InChIKey=UVJKKKIWFDQRIO-UHFFFAOYSA-N

Data  4 IC50

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 561992   

LigandPNGBDBM561992(US11396496, Compound B0 | BDBM50537618)
Affinity DataIC50: 73nMAssay Description:Inhibition of Keap1-Nrf2 Interaction (unknown origin) by fluorescence anisotropyMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetKelch-like ECH-associated protein 1(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM561992(US11396496, Compound B0 | BDBM50537618)
Affinity DataIC50: 73nMAssay Description:Inhibition of FITC-9mer Nrf2 peptide interaction with human recombinant Keap1 Kelch domain (321 to 609 residues) expressed in Escherichia coli DE3 ce...More data for this Ligand-Target Pair
In DepthDetails Article
PubMedPDB3D3D Structure (crystal)
TargetKelch-like ECH-associated protein 1/Nuclear factor erythroid 2-related factor 2(Human)
The Board of Trustees of The University of Illinois

US Patent
LigandPNGBDBM561992(US11396496, Compound B0 | BDBM50537618)
Affinity DataIC50: 74nMAssay Description:The IC50 of the compounds for inhibiting the interaction of a fluorescent NRF2 peptide and the Kelch domain of KEAP1 was determined using fluorescenc...More data for this Ligand-Target Pair
In DepthDetails
US Patent
PDB3D3D Structure (crystal)
TargetKelch-like ECH-associated protein 1(Human)
China Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM561992(US11396496, Compound B0 | BDBM50537618)
Affinity DataIC50: 73nMAssay Description:Inhibition of Keap1 kelch domain to Nrf2 (unknown origin) protein-protein interactionMore data for this Ligand-Target Pair
In DepthDetails
PubMedPDB3D3D Structure (crystal)