BDBM446571 CHEM-US-00084::US10669285, Example 21

SMILES Fc1cc(CCC(=O)N2CCc3nc(nn3CC2)C(=O)N2CCc3[nH]nnc3C2)ccc1OC(F)(F)F

InChI Key InChIKey=PPSXRPJETOLWAU-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 = 446571   

TargetAutotaxin(Human)
Hoffmann-La Roche

US Patent
LigandPNGBDBM446571(CHEM-US-00084 | US10669285, Example 21)
Affinity DataIC50: 17nMAssay 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
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