BDBM73009 1-(2,3-dihydro-1,4-benzoxazin-4-yl)-4-(4-pyridin-2-ylpiperazin-1-yl)butane-1,4-dione::1-(2,3-dihydro-1,4-benzoxazin-4-yl)-4-[4-(2-pyridinyl)-1-piperazinyl]butane-1,4-dione::1-(2,3-dihydro-1,4-benzoxazin-4-yl)-4-[4-(2-pyridyl)piperazino]butane-1,4-dione::MLS001115857::SMR000626080::cid_22513037

SMILES CCO[C@H]1CC[C@H](n2c([C@@H]3CCOC(=O)N3c3ccc(Cl)c(F)c3)nc3cc(C4C(C)=NOC4C)ccc32)CC1

InChI Key InChIKey=NVRSNPSIWQEGEK-UHFFFAOYSA-N

Data  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 73009   

TargetHistone acetyltransferase p300 [1049-1156](Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 73009BDBM73009((S)-3-(4-chloro-3-fluorophenyl)-4-(5-(3,5-dimethyl...)
Affinity DataIC50: 2.10nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/27/2026
Entry Details
US Patent

TargetCREB-binding protein [1085-1192](Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 73009BDBM73009((S)-3-(4-chloro-3-fluorophenyl)-4-(5-(3,5-dimethyl...)
Affinity DataIC50: 2.30nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/27/2026
Entry Details
US Patent