BDBM515159 US11098048, Example 5.04

SMILES O=C(NCc1c[nH]nn1)N1C[C@H]2CCN(C(=O)c3cc(OCC4CCOCC4)nc(C4CC4)c3)CC[C@H]2C1

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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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 515159   

TargetAutotaxin(Human)
Hoffmann-La Roche

US Patent
LigandChemical structure of BindingDB Monomer ID 515159BDBM515159(US11098048, Example 5.04)
Affinity DataIC50: 7nMAssay Description:Assay working solutions were made as follows:Assay buffer (50 mM Tris-HCl, 140 mM NaCl, 5 mM KCl, 1 mM CaCl2), 1 mM MgCl2, 0.01% Triton-X-100, pH 8.0...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/7/2022
Entry Details
US Patent