BDBM50557597 CHEMBL4758133::US11485727, Example 2.6

SMILES CC(=O)N1CC2CC1CN2c1ccc(CNc2ccc(OCc3ccc(nc3)C(F)F)nn2)cc1

InChI Key InChIKey=ZPQWKCILAAPREP-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50557597   

TargetAutotaxin(Human)
Smith, Gambrell & Russell

Curated by ChEMBL
LigandPNGBDBM50557597(CHEMBL4758133 | US11485727, Example 2.6)
Affinity DataIC50: 1.80nMAssay Description:Inhibition of recombinant human C-terminal His6-tagged ATX expressed in baculovirus infected Sf21 insect cells using LPC as substrate incubated for 2...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/26/2022
Entry Details Article
PubMed
TargetAutotaxin(Human)
Smith, Gambrell & Russell

Curated by ChEMBL
LigandPNGBDBM50557597(CHEMBL4758133 | US11485727, Example 2.6)
Affinity DataIC50: 1.80nMAssay Description:5 nM recombinant ATX (Cayman Chemicals) was supplemented to 50 mM Tris buffer (pH 8.0) containing 3 mM KCl, 1 mM CaCl2, 1 mM MgCl2 0.14 mM NaCl, and ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/6/2023
Entry Details
Go to US Patent