BDBM83727 2-(2-Isopropyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-ylsulfanyl)-N-(5-methyl-isoxazol-3-yl)-acetamide::2-(5,6-dimethyl-2-propan-2-yl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)ethanamide::2-(5,6-dimethyl-2-propan-2-ylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)acetamide::2-[(2-isopropyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl)thio]-N-(5-methylisoxazol-3-yl)acetamide::2-[(5,6-dimethyl-2-propan-2-yl-4-thieno[2,3-d]pyrimidinyl)thio]-N-(5-methyl-3-isoxazolyl)acetamide::MLS000077104::SMR000003770::cid_655538

SMILES Cc1ccc2ncc3c(=O)n(CCCC(=O)N4CCN(c5cccc(Cl)c5Cl)CC4)cnc3c2c1

InChI Key InChIKey=UEYJIDFDGLNJJZ-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 = 83727   

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

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 83727BDBM83727(US20250388584, Example 217)
Affinity DataEC50:  1.47E+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