BDBM75851 (E)-2-cyano-3-[4-(dimethylamino)phenyl]-2-propenoic acid [1-(N-methylanilino)-1-oxopropan-2-yl] ester::(E)-2-cyano-3-[4-(dimethylamino)phenyl]acrylic acid [2-keto-1-methyl-2-(N-methylanilino)ethyl] ester::MLS001141423::SMR000707963::[1-(N-methylanilino)-1-oxopropan-2-yl] (E)-2-cyano-3-[4-(dimethylamino)phenyl]prop-2-enoate::[1-[methyl(phenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-2-cyano-3-[4-(dimethylamino)phenyl]prop-2-enoate::cid_16284831

SMILES CNCCOc1cc(NC(=O)c2cc3c(nc2N2CCOCC2)COC3)cc2c(C)cc(=O)[nH]c12

InChI Key InChIKey=TXOSDYDCOWQAJD-UHFFFAOYSA-N

Data  1 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 = 75851   

TargetBromodomain-containing protein 4 [58-164](Human)
Nuevolution

US Patent
LigandChemical structure of BindingDB Monomer ID 75851BDBM75851(N-[4-methyl-8-[2-(methylamino)ethoxy]-2-oxo-1H-qui...)
Affinity DataKd:  20nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/29/2026
Entry Details
US Patent

TargetBromodomain-containing protein 4 [353-454](Human)
Nuevolution

US Patent
LigandChemical structure of BindingDB Monomer ID 75851BDBM75851(N-[4-methyl-8-[2-(methylamino)ethoxy]-2-oxo-1H-qui...)
Affinity DataKd: >5.00E+3nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/29/2026
Entry Details
US Patent

TargetcGMP-inhibited 3',5'-cyclic phosphodiesterase 3A(Human)
Nuevolution

US Patent
LigandChemical structure of BindingDB Monomer ID 75851BDBM75851(N-[4-methyl-8-[2-(methylamino)ethoxy]-2-oxo-1H-qui...)
Affinity DataIC50: 1.00E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/29/2026
Entry Details
US Patent