BDBM75834 5-(4-hydroxy-3,5-dimethyl-benzylidene)-2-thioxo-thiazolidin-4-one::5-[(3,5-dimethyl-4-oxidanyl-phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one::5-[(4-hydroxy-3,5-dimethylphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one::5-[(4-hydroxy-3,5-dimethylphenyl)methylidene]-2-sulfanylidene-4-thiazolidinone::MLS000758553::SMR000528972::cid_3905060

SMILES COc1cc(NC(=O)c2cc3c(nc2N2C[C@H]4C[C@@H]2CO4)COC3)cc2c(C)cc(=O)[nH]c12

InChI Key InChIKey=NPYSSQZXRXNSQT-UHFFFAOYSA-N

Data  1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 75834   

TargetBromodomain-containing protein 4 [58-164](Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 75834BDBM75834(N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-[(...)
Affinity DataKd:  28nMAssay Description:Broad Institute: Reversing Antifungal Drug Resistance Project ID: 2037 Keywords: Candida albicans, drug resistance, Fluconazole, Hsp90, Calcineurin, ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/29/2026
Entry Details
US Patent

TargetBromodomain-containing protein 4 [353-454](Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 75834BDBM75834(N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-[(...)
Affinity DataKd:  700nMAssay Description:Broad Institute: Reversing Antifungal Drug Resistance Project ID: 2037 Keywords: Candida albicans, drug resistance, Fluconazole, Hsp90, Calcineurin, ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/29/2026
Entry Details
US Patent

TargetcGMP-inhibited 3',5'-cyclic phosphodiesterase 3A(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 75834BDBM75834(N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-[(...)
Affinity DataIC50: 1.00E+4nMAssay Description:Broad Institute: Reversing Antifungal Drug Resistance Project ID: 2037 Keywords: Candida albicans, drug resistance, Fluconazole, Hsp90, Calcineurin, ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/29/2026
Entry Details
US Patent