BDBM15375 9-butyl-8-(4-methoxybenzyl)-9H-purin-6-amine::9-butyl-8-[(4-methoxyphenyl)methyl]-9H-purin-6-amine::CHEMBL112834::PU4::Purine-Based Inhibitor 2

SMILES CCCCn1c(Cc2ccc(OC)cc2)nc2c(N)ncnc12

InChI Key InChIKey=NVYATAJRTRFKSW-UHFFFAOYSA-N

Data  2 IC50

PDB links: 1 PDB ID matches this monomer.

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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 15375   

TargetHeat shock protein HSP 90-alpha/90-beta(Homo sapiens (Human))
Ribotargets

Curated by ChEMBL
LigandPNGBDBM15375(9-butyl-8-(4-methoxybenzyl)-9H-purin-6-amine | 9-b...)
Affinity DataIC50: >2.00E+5nMAssay Description:Inhibition of ATP-ase activity in human colon tumour cell line (HCT116)More data for this Ligand-Target Pair
TargetATP-dependent molecular chaperone HSP82(Saccharomyces cerevisiae)
Vernalis (R&D)

LigandPNGBDBM15375(9-butyl-8-(4-methoxybenzyl)-9H-purin-6-amine | 9-b...)
Affinity DataIC50: >2.00E+5nMpH: 7.4 T: 2°CAssay Description:The HSP90 ATPase activity was determined by following the procedure of malachite green assay. The assay is based on quantitation of the green complex...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed