BDBM50550649 CHEMBL4740901

SMILES NCCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC1=O

InChI Key InChIKey=ZPTHNDIZFBPILS-KEOOTSPTSA-N

Data  2 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 4 hits for monomerid = 50550649   

TargetHeat shock protein HSP 90-beta(Homo sapiens (Human))
University Of New South Wales

Curated by ChEMBL
LigandPNGBDBM50550649(CHEMBL4740901)
Affinity DataIC50:  3.72E+3nMAssay Description:Inhibition of C-terminal HSP90beta (527 to 724 residues) (unknown origin) interaction with CYP40 measured after 30 mins by AlphaLISA assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetHeat shock protein HSP 90-alpha/90-beta(Homo sapiens (Human))
University Of New South Wales

Curated by ChEMBL
LigandPNGBDBM50550649(CHEMBL4740901)
Affinity DataKd:  4.50E+4nMAssay Description:Binding affinity to HSP90 C-terminal domain (unknown origin) by biochemical assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetHeat shock protein HSP 90-alpha/90-beta(Homo sapiens (Human))
University Of New South Wales

Curated by ChEMBL
LigandPNGBDBM50550649(CHEMBL4740901)
Affinity DataKd:  1.98E+4nMAssay Description:Binding affinity to recombinant His6-tagged HSP90 C-domain (unknown origin) (553 to 732 residues) expressed in Escherichia coli BL21 (DE3) (DNAY) cel...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetHeat shock protein HSP 90-beta(Homo sapiens (Human))
University Of New South Wales

Curated by ChEMBL
LigandPNGBDBM50550649(CHEMBL4740901)
Affinity DataIC50:  4.00E+3nMAssay Description:Inhibition of C-terminal HSP90beta (527 to 724 residues) (unknown origin) interaction with CYP40 measured after 30 mins by Alphascreen assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed