BDBM72440 2-[3-cyano-6-(4-methylphenyl)-4-(trifluoromethyl)pyridin-2-yl]sulfanylacetic acid::2-[3-cyano-6-(4-methylphenyl)-4-(trifluoromethyl)pyridin-2-yl]sulfanylethanoic acid::2-[[3-cyano-6-(4-methylphenyl)-4-(trifluoromethyl)-2-pyridinyl]thio]acetic acid::2-[[3-cyano-6-(p-tolyl)-4-(trifluoromethyl)-2-pyridyl]thio]acetic acid::MLS000715502::SMR000275481::cid_1083228

SMILES Cc1ccc(cc1)-c1cc(c(C#N)c(SCC(O)=O)n1)C(F)(F)F

InChI Key InChIKey=IPXSVYLPDCRNEI-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 = 72440   

TargetTGF-beta receptor type-1(Human)
Chiesi Farmaceutici

US Patent
LigandChemical structure of BindingDB Monomer ID 72440BDBM72440(1-(4-((2-Fluoro-5-(6-(6-methylpyridin- 2-yl)-2,3-d...)
Affinity DataIC50: 4.60nMAssay 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:
4/15/2026
Entry Details PCBioAssay