BDBM342617 1-(2,5-dimethylphenyl)-3,6,6-trimethyl-2,5,6,7-tetrahydro-4H-isoindol-4-one::US9776990, Example 60

SMILES Cc1[nH]c(c2CC(C)(C)CC(=O)c12)-c1cc(C)ccc1C

InChI Key InChIKey=XWHDXODHBWZBOT-UHFFFAOYSA-N

Data  2 KI

  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 = 342617   

TargetBromodomain-containing protein 4(Human)
Abbvie

US Patent
LigandPNGBDBM342617(1-(2,5-dimethylphenyl)-3,6,6-trimethyl-2,5,6,7-tet...)
Affinity DataKi:  2.70E+3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/12/2019
Entry Details
US Patent

TargetBromodomain-containing protein 4(Human)
Abbvie

US Patent
LigandPNGBDBM342617(1-(2,5-dimethylphenyl)-3,6,6-trimethyl-2,5,6,7-tet...)
Affinity DataKi:  3.37E+3nMAssay Description:Compound dilution series were prepared in DMSO via a 3-fold serial dilution from 2.5 mM to 42 nM. Compounds were then diluted 6:100 in assay buffer (...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/12/2019
Entry Details
US Patent