BDBM75843 4-(7-chloro-4-quinolinyl)-1-piperazinecarboxylic acid ethyl ester::4-(7-chloro-4-quinolyl)piperazine-1-carboxylic acid ethyl ester::MLS001176740::SMR000591939::cid_7783431::ethyl 4-(7-chloranylquinolin-4-yl)piperazine-1-carboxylate::ethyl 4-(7-chloroquinolin-4-yl)piperazine-1-carboxylate

SMILES COc1cc(NC(=O)c2cc3c(nc2N2CCOCC2)CO[C@@H]3C)cc2c(C)cc(=O)[nH]c12

InChI Key InChIKey=XWQZXIDRINXHEZ-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 2 hits for monomerid = 75843   

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

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 75843BDBM75843((5R)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)...)
Affinity DataKd:  14nMAssay 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 75843BDBM75843((5R)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)...)
Affinity DataKd:  1.20E+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