BDBM352386 US9802944, Example 5.04

SMILES [H][C@@]12CN(C[C@]1([H])CCN(CC2)C(=O)c1cc(OCC2CCOCC2)nc(c1)C1CC1)C(=O)NCc1c[nH]nn1

InChI Key InChIKey=NXDRGLQSSLPSFV-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 352386   

TargetAutotaxin(Human)
Hoffmann-La Roche

US Patent
LigandPNGBDBM352386(US9802944, Example 5.04)
Affinity DataIC50: 7nMAssay 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:
10/1/2019
Entry Details
US Patent