BDBM446566 CHEM-US-00079::US10669285, Example 16

SMILES CCc1cc(ccc1OCC(=O)N1CCc2cc(nn2CC1)C(=O)N1CCc2[nH]nnc2C1)C#N

InChI Key InChIKey=YUOJULDAKIAAMA-UHFFFAOYSA-N

Data  1 IC50

  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 = 446566   

TargetAutotaxin(Human)
Hoffmann-La Roche

US Patent
LigandPNGBDBM446566(CHEM-US-00079 | US10669285, Example 16)
Affinity DataIC50: 12nMAssay Description:ATX inhibition was measured by a fluorescence quenching assay using a specifically labeled substrate analogue (MR121 substrate). To obtain this MR121...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/21/2021
Entry Details
Go to US Patent