BDBM50270609 (3E)-3-[(phenylamino)methylidene]dihydrofuran-2(3H)-one::(E)-3-((phenylamino)methylene)-dihydrofuran-2(3H)-one::CHEMBL486921::HSP90 Inhibitor, 3

SMILES O=C1OCCC1=CNc1ccccc1

InChI Key InChIKey=BKXNPYSVWOVZGX-UHFFFAOYSA-N

Data  3 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50270609   

TargetHeat shock protein HSP 90-alpha(Human)
Abbott Laboratories

LigandPNGBDBM50270609(CHEMBL486921 | HSP90 Inhibitor, 3 | (3E)-3-[(pheny...)
Affinity DataKd:  1.50E+5nMpH: 7.5 T: 2°CAssay Description:HSP90 inhibitors identified using NMR fragment-based screening assay.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/7/2011
Entry Details Article
PubMed
TargetHeat shock protein HSP 90-beta(Human)
Astex Therapeutics

Curated by ChEMBL
LigandPNGBDBM50270609(CHEMBL486921 | HSP90 Inhibitor, 3 | (3E)-3-[(pheny...)
Affinity DataKd:  1.50E+5nMAssay Description:Binding affinity to HSP90More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetHeat shock protein HSP 90-alpha/90-beta(Human)
University of Lyon

Curated by ChEMBL
LigandPNGBDBM50270609(CHEMBL486921 | HSP90 Inhibitor, 3 | (3E)-3-[(pheny...)
Affinity DataKd:  1.50E+5nMAssay Description:Binding affinity to N-terminal human HSP90 (D9 to E236 residues) expressed in Escherichia coli BL21(DE3) by 1H-13C HSQC-NMR spectroscopyMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/21/2022
Entry Details Article
PubMed