BDBM50240875 CHEMBL4080323

SMILES Cc1cnc(c(c1OC)C)Cn2c3c(cn2)c(nc(n3)N)Cl

InChI Key InChIKey=IKGRZHVFOMUXCQ-UHFFFAOYSA-N

Data  2 IC50

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50240875   

TargetHeat shock protein HSP 90-alpha(Human)
Ulsan National Institutes of Science and Technology (Unist)

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50240875BDBM50240875(CHEMBL4080323)
Affinity DataIC50: 97nMAssay Description:Inhibition of FITC3-labeled PU-H71 binding to recombinant HSP90alpha (unknown origin) after 24 hrs by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/7/2019
Entry Details Article
PubMed
TargetHeat shock protein 75 kDa, mitochondrial(Human)
Ulsan National Institutes of Science and Technology (Unist)

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50240875BDBM50240875(CHEMBL4080323)
Affinity DataIC50: 138nMAssay Description:Inhibition of FITC3-labeled PU-H71 binding to recombinant human N-terminal His6-tagged TRAP1 (60 to 561 residues) expressed in Escherichia coli BL21(...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/7/2019
Entry Details Article
PubMedPDB3D3D Structure (crystal)