BDBM481923 4-{(3aR,6aR)-5-[3-(4-Trifluoromethoxy-phenyl)-propionyl]-hexahydro-pyrrolo[3,4-c]pyrrole-2-carbonyl}-benzenesulfonamide::US10913745, Example 8

SMILES NS(=O)(=O)c1ccc(cc1)C(=O)N1C[C@H]2CN(C[C@@H]2C1)C(=O)CCc1ccc(OC(F)(F)F)cc1

InChI Key InChIKey=PMLFIVAOETXTTK-UHFFFAOYSA-N

Data  1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 481923   

TargetAutotaxin(Human)
Hoffmann-La Roche

US Patent
LigandPNGBDBM481923(US10913745, Example 8 | 4-{(3aR,6aR)-5-[3-(4-Trifl...)
Affinity DataIC50: 8.5nMAssay Description: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;ATX solution: ATX (human His-tagged) stock so...More data for this Ligand-Target Pair
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Date in BDB:
8/30/2021
Entry Details
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