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BDBM69365 2-(3,3-dimethyl-2-oxidanylidene-butylidene)-5-[(4-methoxy-3-oxidanyl-phenyl)methylidene]-1,3-thiazolidin-4-one::2-(3,3-dimethyl-2-oxobutylidene)-5-[(3-hydroxy-4-methoxyphenyl)methylidene]-1,3-thiazolidin-4-one::2-(3,3-dimethyl-2-oxobutylidene)-5-[(3-hydroxy-4-methoxyphenyl)methylidene]-4-thiazolidinone::5-(3-hydroxy-4-methoxy-benzylidene)-2-(2-keto-3,3-dimethyl-butylidene)thiazolidin-4-one::MLS000773832::SMR000364701::cid_4794224

SMILES: COc1ccc(C=c2sc(=CC(=O)C(C)(C)C)[nH]c2=O)cc1O

InChI Key: InChIKey=QGGLCGBRBYFWPB-FPLYRLCPSA-N

Data: 2 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 69365   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Hsf1 protein


(Mus musculus)
BDBM69365
PNG
(2-(3,3-dimethyl-2-oxidanylidene-butylidene)-5-[(4-...)
Show SMILES COc1ccc(C=c2sc(=CC(=O)C(C)(C)C)[nH]c2=O)cc1O
Show InChI InChI=1S/C17H19NO4S/c1-17(2,3)14(20)9-15-18-16(21)13(23-15)8-10-5-6-12(22-4)11(19)7-10/h5-9,19H,1-4H3,(H,18,21)/b13-8+,15-9-
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 4.18E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2P55KXK
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM69365
PNG
(2-(3,3-dimethyl-2-oxidanylidene-butylidene)-5-[(4-...)
Show SMILES COc1ccc(C=c2sc(=CC(=O)C(C)(C)C)[nH]c2=O)cc1O
Show InChI InChI=1S/C17H19NO4S/c1-17(2,3)14(20)9-15-18-16(21)13(23-15)8-10-5-6-12(22-4)11(19)7-10/h5-9,19H,1-4H3,(H,18,21)/b13-8+,15-9-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 7.20E+3n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: GSK3beta, dose response, kinase, inhibition, HTS Assay Overview: The glycogen synthase kinase-3 beta (GSK-3b) is a known master regulator f...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2TX3CTT
More data for this
Ligand-Target Pair