BDBM83407 MLS001176629::N-[2-(dimethylamino)-2-(2-furanyl)ethyl]-3-(trifluoromethyl)benzamide::N-[2-(dimethylamino)-2-(2-furyl)ethyl]-3-(trifluoromethyl)benzamide::N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(trifluoromethyl)benzamide::SMR000596426::cid_4803620

SMILES Cc1ccc(N2CCN(C(=O)CCn3cnc4c([nH]c5ccc(C)cc54)c3=O)CC2)c(C)c1

InChI Key InChIKey=HQGXNVWYVJRNIR-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 = 83407   

TargetThiamine pyrophosphokinase 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 83407BDBM83407(3-(4-(4-(2,3-dichlorophenyl)piperazin-1-yl)butyl)-...)
Affinity DataEC50:  1.21E+3nMAssay Description:Keywords: apoptosis, BH3 domain, Bcl2-A1, BIM, caspase, cancer Primary Collaborator: Todd Golub, Broad Institute, golub@broadinstitute.org Assay Over...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2026
Entry Details
US Patent