BDBM83322 1-[2-(dimethylamino)-2-(3-pyridinyl)ethyl]-3-phenylthiourea::1-[2-(dimethylamino)-2-(3-pyridyl)ethyl]-3-phenyl-thiourea::1-[2-(dimethylamino)-2-pyridin-3-yl-ethyl]-3-phenyl-thiourea::1-[2-(dimethylamino)-2-pyridin-3-ylethyl]-3-phenylthiourea::MLS000720315::SMR000236202::cid_3418043

SMILES Cc1ccc2[nH]c3c(=O)n(CCC(=O)N4CCN(c5cc(Cl)ccc5Cl)CC4)cnc3c2c1

InChI Key InChIKey=FVVXMBTYFRNMAK-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 = 83322   

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

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 83322BDBM83322(3-(3-(4-(2,5-dichlorophenyl)piperazin-1-yl)-3-oxop...)
Affinity DataEC50:  2.05E+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