BDBM398062 2-(6-((E)-2- ((3R,3aS,4R,5S,7aR)- 6,6-difluoro-3,5- dimethyl-1-oxo-7a-(5- phenyl-1,3,4- oxadiazol-2-yl) octahydroisobenzofuran- 4-yl)vinyl)pyridin-3- yl)-6-ethylbenzonitrile::US10322140, Example 7

SMILES C[C@H]1OC(=O)[C@@]2(CC(F)(F)[C@@H](C)[C@H](\C=C\c3ccc(cn3)-c3cccc(C)c3C#N)[C@H]12)c1nnc(o1)-c1ccccc1

InChI Key InChIKey=ADEJAFDVVGZPGW-KSMSIPAFSA-N

Data  2 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 2 hits for monomerid = 398062   

TargetCytochrome P450 3A4(Homo sapiens (Human))
TBA

US Patent
LigandPNGBDBM398062(2-(6-((E)-2- ((3R,3aS,4R,5S,7aR)- 6,6-difluoro-3,5...)
Affinity DataIC50:  5.00E+4nMAssay Description:Compound dilutions and assay-ready plates were prepared on a TTP Labtech mosquito HTS. Assay conduction was fully automated on a customized Screening...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent
TargetProteinase-activated receptor 1(Homo sapiens (Human))
TBA

US Patent
LigandPNGBDBM398062(2-(6-((E)-2- ((3R,3aS,4R,5S,7aR)- 6,6-difluoro-3,5...)
Affinity DataIC50:  5.01nMAssay Description:Frozen HEK 293 Cells were plated in 384-well PDL coated plates at 12000 cells/well in 50 uL of DMEM media containing 10% FBS, pen/strep/L-Glutamine a...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent