BDBM96702 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-phenylethylamino)ethanone;ethanedioic acid::1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-phenylethylamino)ethanone;oxalic acid::1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(phenethylamino)ethanone;oxalic acid::MLS001007424::SMR000352617::cid_16195935

SMILES CCC1(CC)CCN(C(=O)Nc2ccc(C)c(CCc3cc(Nc4nccnc4C)[nH]n3)c2)C1

InChI Key InChIKey=OZKNLHUHDSYABU-UHFFFAOYSA-N

Data  2 IC50  2 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 = 96702   

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

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 96702BDBM96702(3,3-diethyl-N-(4-methyl-3-(2-(5-((3-methylpyrazin-...)
Affinity DataIC50: 5nMAssay 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