BDBM50568478 CHEMBL4860663::US12122742, Compound I-d-3

SMILES OC(=O)CN(c1ccc(N(CC(O)=O)S(=O)(=O)c2cc3OCCOc3cc2Cl)c2ccccc12)S(=O)(=O)c1cc2OCCOc2cc1Cl

InChI Key InChIKey=PTEDJVLKBYNKJK-UHFFFAOYSA-N

Data  4 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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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50568478   

TargetNuclear factor erythroid 2-related factor 2(Human)
The State University of New Jersey

Curated by ChEMBL
LigandPNGBDBM50568478(CHEMBL4860663 | US12122742, Compound I-d-3)
Affinity DataIC50: 144nMAssay Description:Inhibition of recombinant human KEAP1 Kelch domain (321 to 609 residues) expressed in Escherichia coli BL21 (DE3)pLysS cells interaction with FITC-9m...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2022
Entry Details Article
PubMed
TargetNuclear factor erythroid 2-related factor 2(Human)
The State University of New Jersey

Curated by ChEMBL
LigandPNGBDBM50568478(CHEMBL4860663 | US12122742, Compound I-d-3)
Affinity DataIC50: 8.90nMAssay Description:Inhibition of recombinant human KEAP1 Kelch domain (321 to 609 residues) expressed in Escherichia coli BL21 (DE3)pLysS cells interaction with FITC-9m...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2022
Entry Details Article
PubMed
TargetKelch-like ECH-associated protein 1/Nuclear factor erythroid 2-related factor 2(Human)
Rutgers, The State University of New Jersey

US Patent
LigandPNGBDBM50568478(CHEMBL4860663 | US12122742, Compound I-d-3)
Affinity DataIC50: 144nMAssay Description:Fluorescence polarization assay was performed on a Wallac Victor 3V multi-label counter/plate reader (PerkinElmer, Shelton, CT) using 484 nm excitati...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2025
Entry Details
Go to US Patent

TargetKelch-like ECH-associated protein 1/Nuclear factor erythroid 2-related factor 2(Human)
Rutgers, The State University of New Jersey

US Patent
LigandPNGBDBM50568478(CHEMBL4860663 | US12122742, Compound I-d-3)
Affinity DataIC50: 146nMAssay Description:Fluorescence polarization assay was performed on a Wallac Victor 3V multi-label counter/plate reader (PerkinElmer, Shelton, CT) using 484 nm excitati...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2025
Entry Details
Go to US Patent