BDBM352309 CHEM-US-00053::US9802944, Example 1.16

SMILES [H][C@@]12CC(C[C@@]1([H])CN(C2)C(=O)c1cc(OCC2CCOCC2)cc(c1)C1CC1)C(=O)[C@@H]1CCc2[nH]nnc2C1

InChI Key InChIKey=MGTRCZJWPRZJRO-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
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 352309   

TargetAutotaxin(Human)
Hoffmann-La Roche

US Patent
LigandPNGBDBM352309(US9802944, Example 1.16 | CHEM-US-00053)
Affinity DataIC50: 6nMAssay 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