BDBM46479 5-[2-(2,5-dimethylphenoxy)ethanoylamino]benzene-1,3-dicarboxylic acid::5-[[2-(2,5-dimethylphenoxy)-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid::5-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzene-1,3-dicarboxylic acid::5-[[2-(2,5-dimethylphenoxy)acetyl]amino]isophthalic acid::5-{[(2,5-dimethylphenoxy)acetyl]amino}isophthalic acid::MLS000693318::SMR000299853::cid_976437

SMILES C=CC(=O)N1CC(OC2CC3(COC3)C2)c2nn(-c3ccc(C4CCC4)cc3)c3c2C(C1)N(C(=O)c1cnc(C(F)(F)F)cc1N)CC3

InChI Key InChIKey=GGOPAQBAMXZPPG-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 46479   

LigandChemical structure of BindingDB Monomer ID 46479BDBM46479(1-(9-((2- oxaspiro[3.3]heptan-6- yl)oxy)-5-(4-amin...)
Affinity DataIC50: 1.5nMAssay Description:Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/26/2026
Entry Details
US Patent

LigandChemical structure of BindingDB Monomer ID 46479BDBM46479(1-(9-((2- oxaspiro[3.3]heptan-6- yl)oxy)-5-(4-amin...)
Affinity DataIC50: 10nMAssay Description:Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/26/2026
Entry Details
US Patent