BDBM72677 2-[4-(2-Chloro-benzyl)-2,2-dimethyl-tetrahydro-pyran-4-yl]-ethylamine::2-[4-(2-chlorobenzyl)-2,2-dimethyl-tetrahydropyran-4-yl]ethylamine::2-[4-[(2-chlorophenyl)methyl]-2,2-dimethyl-4-oxanyl]ethanamine::2-[4-[(2-chlorophenyl)methyl]-2,2-dimethyl-oxan-4-yl]ethanamine::2-[4-[(2-chlorophenyl)methyl]-2,2-dimethyloxan-4-yl]ethanamine::MLS000333621::SMR000437779::cid_4532541

SMILES CC(C)Nc1c(C(=O)N[C@H]2CC[C@H](N)CC2)cnc2ccc(-c3cn[nH]c3)cc12

InChI Key InChIKey=YFTUDCNWQVREPF-UHFFFAOYSA-N

Data  1 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 = 72677   

TargetInterleukin-1 receptor-associated kinase 4(Human)
Bristol-Myers Squibb

US Patent
LigandChemical structure of BindingDB Monomer ID 72677BDBM72677(US12492186, Example 23)
Affinity DataIC50: 7.20nMAssay 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:
4/20/2026
Entry Details
US Patent