BDBM50657040 CHEMBL6108997

SMILES CCCNC(=O)c1ccc(NC(=O)c2[nH]c(C)c(Cl)c2Cl)c(OC2CCN(C)CC2)c1

InChI Key InChIKey=LDVQJDQGUZDRLL-UHFFFAOYSA-N

Data  1 IC50  2 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50657040   

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

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50657040BDBM50657040(CHEMBL6108997)
Affinity DataKd:  2.60E+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
TargetHeat shock protein HSP 90-alpha(Human)
University of Ljubljana

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50657040BDBM50657040(CHEMBL6108997)
Affinity DataKd:  2.30E+4nMAssay Description:Binding affinity to N-terminal His6-tagged human HSP90alpha (1 to 241 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 50657040BDBM50657040(CHEMBL6108997)
Affinity DataIC50: 5.80E+4nMAssay 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