BDBM100256 8-[8-(1H-benzimidazol-2-yl)octyl]-1,3-dimethyl-7H-purine-2,6-dione::8-[8-(1H-benzimidazol-2-yl)octyl]-1,3-dimethyl-7H-purine-2,6-quinone::MLS002694437::SMR001560366::cid_255762

SMILES CNCc1cc(-c2ccc(OCCc3cc(F)cc(F)c3)cc2F)n(S(=O)(=O)c2cccnc2)c1

InChI Key InChIKey=YROFFLLIXZJIPV-UHFFFAOYSA-N

Data  2 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 1 hit for monomerid = 100256   

LigandChemical structure of BindingDB Monomer ID 100256BDBM100256(US20260001864, Compound 99)
Affinity DataIC50: 72.6nMAssay 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