BDBM83766 (2,2,4-trimethyl-1H-quinolin-6-yl) 3-(1,3-dioxoisoindol-2-yl)propanoate::(2,2,4-trimethyl-1H-quinolin-6-yl) 3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate::3-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-propionic acid 2,2,4-trimethyl-1,2-dihydro-quinolin-6-yl ester::3-(1,3-dioxo-2-isoindolyl)propanoic acid (2,2,4-trimethyl-1H-quinolin-6-yl) ester::3-phthalimidopropionic acid (2,2,4-trimethyl-1H-quinolin-6-yl) ester::MLS000566453::SMR000177480::cid_1349589

SMILES CC(C)C(=O)N1CCCN(c2ncnc3c2c2ccc(S(=O)(=O)NC4(C#N)CC4)cc2n3-c2nnc(C(F)F)s2)CC1

InChI Key InChIKey=CCEMPJLPXREAQW-UHFFFAOYSA-N

Data  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 83766   

TargetPoly(ADP-ribose) glycohydrolase(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 83766BDBM83766(N-(1-Cyanocyclopropyl)-9-(5- (difluoromethyl)-1,3,...)
Affinity DataIC50: 0.000100nMAssay Description:Keywords: apoptosis, BH3 domain, Bcl2-A1, BIM, caspase, cancer Primary Collaborator: Todd Golub, Broad Institute, golub@broadinstitute.org Assay Over...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2026
Entry Details
US Patent