BDBM50165271 9-Butyl-8-(3-methoxy-phenylsulfanyl)-9H-purin-6-ylamine::CHEMBL195869

SMILES CCCCn1c(Sc2cccc(OC)c2)nc2c(N)ncnc12

InChI Key InChIKey=FGVWJELBOMNOGZ-UHFFFAOYSA-N

Data  1 IC50  1 EC50

  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 2 hits for monomerid = 50165271   

TargetHeat shock protein HSP 90-alpha/90-beta(Homo sapiens (Human))
Memorial Sloan-Kettering Cancer Center

Curated by ChEMBL
LigandPNGBDBM50165271(9-Butyl-8-(3-methoxy-phenylsulfanyl)-9H-purin-6-yl...)
Affinity DataIC50:  5.37E+4nMAssay Description:Inhibition of Hsp90 protein as degradation of HER2 kinase in SKBr3 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHeat shock protein HSP 90-alpha(Mus musculus)
Memorial Sloan-Kettering Cancer Center

Curated by ChEMBL
LigandPNGBDBM50165271(9-Butyl-8-(3-methoxy-phenylsulfanyl)-9H-purin-6-yl...)
Affinity DataEC50:  4.60E+3nMAssay Description:Displacement of 5 nM GM-BODIPY from mouse heat shock protein HSP90-alphaMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed