BDBM66789 4-keto-4-[3-[3-keto-3-(2,3,4,5,6-pentamethylphenyl)propyl]anilino]butyric acid::4-oxidanylidene-4-[[3-[3-oxidanylidene-3-(2,3,4,5,6-pentamethylphenyl)propyl]phenyl]amino]butanoic acid::4-oxo-4-[3-[3-oxo-3-(2,3,4,5,6-pentamethylphenyl)propyl]anilino]butanoic acid::MLS001181629::SMR000567305::cid_2803562

SMILES Cc1c(C)c(C)c(C(=O)CCc2cccc(NC(=O)CCC(O)=O)c2)c(C)c1C

InChI Key InChIKey=TTYOSKNFAVRAHL-UHFFFAOYSA-N

Data  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 66789   

TargetPhosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform(Human)
Sloan-Kettering Institute For Cancer Research

US Patent
LigandChemical structure of BindingDB Monomer ID 66789BDBM66789(US12478616, Compound (15))
Affinity DataIC50: 500nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/6/2026
Entry Details ArticlePubMed