BDBM473877 2-hydroxy-5-(N- isobutylphenyl- sulfonamido) benzoic acid::US10858316, Compound JY-5-296

SMILES CC(C)CN(c1ccc(O)c(c1)C(O)=O)S(=O)(=O)c1ccccc1

InChI Key InChIKey=ZTEWDWARCIBIPB-UHFFFAOYSA-N

Data  3 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 473877   

TargetInduced myeloid leukemia cell differentiation protein Mcl-1(Human)
University of Maryland, Baltimore

US Patent
LigandPNGBDBM473877(2-hydroxy-5-(N- isobutylphenyl- sulfonamido) benzo...)
Affinity DataKi:  4.65E+4nMAssay Description:Molecular modeling and SILCS functional group affinity mapping (FragMaps) of the Mcl-1 binding site indicated that the carboxylic acid of designed mo...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/11/2021
Entry Details
US Patent

TargetInduced myeloid leukemia cell differentiation protein Mcl-1(Human)
University of Maryland, Baltimore

US Patent
LigandPNGBDBM473877(2-hydroxy-5-(N- isobutylphenyl- sulfonamido) benzo...)
Affinity DataKi:  4.65E+4nMAssay Description:Inhibition of FITC-labelled BAK BH3 peptide to 6His-MBP tagged recombinant human MCL-1 (172 to 327 residues) expressed in Escherichia coli assessed a...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed
TargetBcl-2-like protein 1(Human)
University of Maryland

Curated by ChEMBL
LigandPNGBDBM473877(2-hydroxy-5-(N- isobutylphenyl- sulfonamido) benzo...)
Affinity DataKi:  4.93E+4nMAssay Description:Binding affinity to BCL-xL (unknown origin) assessed as inhibition constantMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2024
Entry Details
PubMed