BDBM466245 US10793582, Example 41

SMILES CCc1nc(nc2nc(sc12)N1CCC[C@@H]1C(=O)NCc1ccccc1)C1CC1

InChI Key InChIKey=QMAYHUPHYPVILJ-QGZVFWFLSA-N

Data  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 1 hit for monomerid = 466245   

TargetKynurenine/alpha-aminoadipate aminotransferase, mitochondrial(Homo sapiens (Human))
Mitsubishi Tanabe Pharma

US Patent
LigandPNGBDBM466245(US10793582, Example 41)
Affinity DataIC50:  170nMAssay Description:To a reaction mixture (45 μL) containing 3.0 μmol/L kynurenine, 10 μmol/L pyridoxal phosphate, 2.0 ng/μL human recombinant KAT-II...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent