BDBM50657046 CHEMBL6164020

SMILES Cc1[nH]c(C(=O)Nc2ccc(C(N)=O)cc2N2CCC3(CCN(C)C3)C2)c(Cl)c1Cl

InChI Key InChIKey=ALEHVHFDNQESCR-UHFFFAOYSA-N

Data  1 IC50  2 Kd

  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 3 hits for monomerid = 50657046   

TargetHeat shock protein HSP 90-beta(Human)
University of Ljubljana

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50657046BDBM50657046(CHEMBL6164020)
Affinity DataKd:  5.20E+3nMAssay Description:Binding affinity to HSP90beta N-terminal domain (unknown origin) by ITC methodMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/4/2026
Entry Details
PubMed
TargetHeat shock protein HSP 90-beta(Human)
University of Ljubljana

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50657046BDBM50657046(CHEMBL6164020)
Affinity DataKd:  7.30E+3nMAssay Description:Binding affinity to N-terminal His6-tagged human HSP90beta (1 to 239 residues) expressed in Escherichia coli BL21(DE3) cells by fluorescence thermal ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/4/2026
Entry Details
PubMed
TargetDNA topoisomerase 2-alpha(Human)
University of Ljubljana

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50657046BDBM50657046(CHEMBL6164020)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of human DNA topoisomerase 2-alpha using supercoiled pNO1 plasmid as substrate incubated for 30 mins by fluorescence based microplate read...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/4/2026
Entry Details
PubMed