BDBM50165317 9-(2-Isopropoxy-ethyl)-8-(3,4,5-trimethoxy-benzenesulfonyl)-9H-purin-6-ylamine::CHEMBL193313

SMILES COc1cc(cc(OC)c1OC)S(=O)(=O)c1nc2c(N)ncnc2n1CCOC(C)C

InChI Key InChIKey=GJEOVLOAQBMXCG-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 = 50165317   

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

Curated by ChEMBL
LigandPNGBDBM50165317(9-(2-Isopropoxy-ethyl)-8-(3,4,5-trimethoxy-benzene...)
Affinity DataIC50: 5.00E+5nMAssay Description:Inhibition of Hsp90 protein as degradation of HER2 kinase in SKBr3 cellsMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetHeat shock protein HSP 90-alpha(Mouse)
Memorial Sloan-Kettering Cancer Center

Curated by ChEMBL
LigandPNGBDBM50165317(9-(2-Isopropoxy-ethyl)-8-(3,4,5-trimethoxy-benzene...)
Affinity DataEC50: >5.00E+4nMAssay Description:Displacement of 5 nM GM-BODIPY from mouse heat shock protein HSP90-alphaMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed