BDBM75841 5-[(2R,3R,4S,5R)-5-methoxy-6,6-dimethyl-3,4-bis(oxidanyl)oxan-2-yl]oxy-2-(4-phenoxyphenyl)-N-(phenylmethyl)benzamide::5-[[(2R,3R,4S,5R)-3,4-dihydroxy-5-methoxy-6,6-dimethyl-2-oxanyl]oxy]-2-(4-phenoxyphenyl)-N-(phenylmethyl)benzamide::MLS000879545::N-benzyl-5-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methoxy-6,6-dimethyl-tetrahydropyran-2-yl]oxy-2-(4-phenoxyphenyl)benzamide::N-benzyl-5-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methoxy-6,6-dimethyloxan-2-yl]oxy-2-(4-phenoxyphenyl)benzamide::SMR000525503::cid_16664653

SMILES CCN(c1nc2c(cc1C(=O)Nc1cc(OC)c3[nH]c(=O)cc(C)c3c1)COC2)C(C)C

InChI Key InChIKey=ORJVIAIBWQQPAU-UHFFFAOYSA-N

Data  1 IC50

  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 2 hits for monomerid = 75841   

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

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 75841BDBM75841(2-[ethyl(isopropyl)amino]-N-(8-methoxy-4-methyl-2-...)
Affinity DataKd:  33nMAssay 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 75841BDBM75841(2-[ethyl(isopropyl)amino]-N-(8-methoxy-4-methyl-2-...)
Affinity DataKd:  1.00E+3nMAssay 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