BDBM258488 US10633384, Example 1.09::US9493486, 1.09

SMILES CS(=O)(=O)c1cc(cc(c1)Cl)COC(=O)N2CCC3(CC2)CN(C3)C(=O)c4ccc5c(c4)nn[nH]5

InChI Key InChIKey=KJIYUARBMWVZFP-UHFFFAOYSA-N

Data  2 IC50

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 258488   

TargetAutotaxin(Human)
Hoffmann-La Roche

US Patent
LigandChemical structure of BindingDB Monomer ID 258488BDBM258488(US9493486, 1.09 | US10633384, Example 1.09)
Affinity DataIC50: 50.5nMpH: 8.0 T: 2°CAssay 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:
11/20/2017
Entry Details
US Patent
PDB3D3D Structure (crystal)
TargetAutotaxin(Human)
Hoffmann-La Roche

US Patent
LigandChemical structure of BindingDB Monomer ID 258488BDBM258488(US9493486, 1.09 | US10633384, Example 1.09)
Affinity DataIC50: 50.5nMAssay 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:
1/12/2021
Entry Details
US Patent
PDB3D3D Structure (crystal)