BDBM114971 MLS000103591::N-(1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)-3-phenylpropanamide::N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-3-phenylpropanamide::N-(2,6-diketo-1,3-dimethyl-pyrimidin-4-yl)-3-phenyl-propionamide::N-[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]-3-phenyl-propanamide::SMR000018868::cid_2148465

SMILES COC(C)(C)CO[C@H]1CC[C@H](NC(=O)c2cc(C)nc(-n3ccnc3)n2)CC1

InChI Key InChIKey=PWNLOMKLYXYKRC-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 1 hit for monomerid = 114971   

TargetADP-ribosyl cyclase/cyclic ADP-ribose hydrolase 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 114971BDBM114971(US12514858, Example 61)
Affinity DataIC50: 13.4nMAssay 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:
5/18/2026
Entry Details
US Patent