BDBM20778 8-[(7-chloro-1,3-benzothiazol-2-yl)sulfanyl]-9-{2-[(2,2-dimethylpropyl)amino]ethyl}-9H-purin-6-amine::Benzothiazole analogue, 36::CHEMBL215657

SMILES CC(C)(C)CNCCn1c(Sc2nc3cccc(Cl)c3s2)nc2c(N)ncnc12

InChI Key InChIKey=YLCDEKPILDISJG-UHFFFAOYSA-N

Data  1 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 20778   

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

Curated by ChEMBL
LigandPNGBDBM20778(8-[(7-chloro-1,3-benzothiazol-2-yl)sulfanyl]-9-{2-...)
Affinity DataIC50:  110nMAssay Description:Inhibition of Hsp90 in human MCF7 cells assessed as Her2 degradationMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHeat shock protein HSP 90-beta(Homo sapiens (Human))
Memorial Sloan-Kettering Cancer Center

Curated by ChEMBL
LigandPNGBDBM20778(8-[(7-chloro-1,3-benzothiazol-2-yl)sulfanyl]-9-{2-...)
Affinity DataEC50:  35nMAssay Description:EC50 was defined as the concentration of the compound at which there was 50% degradation of the Her-2/neu protein in MCF7 breast carcinoma cells. Sam...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed