BDBM50509827 CHEMBL4544508

SMILES COC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)c1cc2c(Cl)cc(Cl)cc2[nH]1

InChI Key InChIKey=BIGIOGZXGNXUFF-UHFFFAOYSA-N

Data  1 KI  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50509827   

TargetCatenin beta-1 (138-781), Transcription Factor 4 (7-51), and Cadherin-1 (819-873)(Human)
H. Lee Moffitt Cancer Center and Research Institute

US Patent
LigandPNGBDBM50509827(CHEMBL4544508 | US20250289848, Example 19)
Affinity DataKi:  4.30E+3nMAssay Description:Experiments were performed in 96-well Microfluor 2 black plates on a Synergy 2 plate reader (Biotek). The polarization was measured at room temperatu...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/4/2026
Entry Details
US Patent

TargetCatenin beta-1(Human)
H. Lee Moffitt Cancer Center and Research Institute

Curated by ChEMBL
LigandPNGBDBM50509827(CHEMBL4544508 | US20250289848, Example 19)
Affinity DataKi:  4.30E+3nMAssay Description:Inhibition of C-terminal fluorescein-labeled human TCF4 (7 to 51 residues) binding to wild-type C-terminal His6-tagged beta-catenin (138 to 781 resid...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/20/2021
Entry Details Article
PubMed
TargetCatenin beta-1(Human)
H. Lee Moffitt Cancer Center and Research Institute

Curated by ChEMBL
LigandPNGBDBM50509827(CHEMBL4544508 | US20250289848, Example 19)
Affinity DataIC50: 1.70E+4nMAssay Description:Inhibition of C-terminal fluorescein-labeled human TCF4 (7 to 51 residues) binding to wild-type C-terminal His6-tagged beta-catenin (138 to 781 resid...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/20/2021
Entry Details Article
PubMed