BDBM114726 (E)-3-(3-nitroanilino)-1-(2-thienyl)prop-2-en-1-one::(E)-3-(3-nitroanilino)-1-thiophen-2-yl-2-propen-1-one::(E)-3-(3-nitroanilino)-1-thiophen-2-ylprop-2-en-1-one::(E)-3-[(3-nitrophenyl)amino]-1-thiophen-2-yl-prop-2-en-1-one::3-[(3-nitrophenyl)amino]-1-(2-thienyl)-2-propen-1-one::MLS000537687::SMR000143911::cid_2211323

SMILES CCC(c1ncccn1)N(C)c1nc2c(c(C#N)nn2C(C)c2ccc(C(F)(F)F)nc2)c(=O)[nH]1

InChI Key InChIKey=VCRGFILYJCNWQE-UHFFFAOYSA-N

Data  2 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 = 114726   

TargetHigh affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 114726BDBM114726(6-[methyl(1- pyrimidin-2- ylpropyl)amino]- 4-oxo-1...)
Affinity DataKi:  9.98nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/13/2026
Entry Details
US Patent