BDBM96706 5-[2,5-dimethyl-1-(2-oxolanylmethyl)-3-pyrrolyl]-N-(2-phenylethyl)-6H-1,3,4-thiadiazin-2-amine::5-[2,5-dimethyl-1-(oxolan-2-ylmethyl)pyrrol-3-yl]-N-(2-phenylethyl)-6H-1,3,4-thiadiazin-2-amine::MLS000516835::SMR000342950::[5-[2,5-dimethyl-1-(tetrahydrofurfuryl)pyrrol-3-yl]-6H-1,3,4-thiadiazin-2-yl]-phenethyl-amine::cid_4591140

SMILES Cc1ccc(NC(=O)NC2CCC(C)(C)CC2)cc1CCc1cc(NC(=O)c2ccc(N3CCN(C)CC3)cc2)[nH]n1

InChI Key InChIKey=IOUBKDMPWNIBMZ-UHFFFAOYSA-N

Data  2 IC50  2 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 96706   

TargetTyrosine-protein kinase Fyn(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 96706BDBM96706(N-(3-(5-(3-(4,4-dimethylcyclohexyl)ureido)-2-methy...)
Affinity DataIC50: 3nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/11/2026
Entry Details
US Patent