BDBM516884 US11104665, Example 1.5

SMILES CC(=O)N1CCN(CC1)c1ccc(CNc2ccc(OCc3ccc(OC(F)(F)F)nc3)nn2)cc1

InChI Key InChIKey=JSUVAPSDLIBFIC-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 516884   

TargetAutotaxin(Human)
Therachem Research Medilab

Curated by ChEMBL
LigandPNGBDBM516884(US11104665, Example 1.5)
Affinity DataIC50: 4nMAssay Description:Inhibition of recombinant human autotaxin assessed as reduction in LPA production using LPC as substrate after 2 hrs by Rapidfire-MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2022
Entry Details Article
PubMed
TargetAutotaxin(Human)
Therachem Research Medilab

Curated by ChEMBL
LigandPNGBDBM516884(US11104665, Example 1.5)
Affinity DataIC50: 4nMAssay 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:
2/13/2022
Entry Details
US Patent

TargetAutotaxin(Human)
Therachem Research Medilab

Curated by ChEMBL
LigandPNGBDBM516884(US11104665, Example 1.5)
Affinity DataIC50: 9nMAssay Description:Inhibition of ATX in human whole blood assessed as reduction in LPA level after 1 hr by rapidFire based MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2022
Entry Details Article
PubMed