BDBM20759 8-[(7-bromo-1,3-benzothiazol-2-yl)sulfanyl]-9-butyl-9H-purin-6-amine::Benzothiazole analogue, 12

SMILES CCCCn1c(Sc2nc3cccc(Br)c3s2)nc2c(N)ncnc12

InChI Key InChIKey=IALDHNPJIRAPBQ-UHFFFAOYSA-N

Data  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 20759   

TargetHeat shock protein HSP 90-beta(Human)
Conforma Therapeutics

LigandPNGBDBM20759(8-[(7-bromo-1,3-benzothiazol-2-yl)sulfanyl]-9-buty...)
Affinity DataEC50:  330nMpH: 7.2 T: 2°CAssay 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 Depth
Date in BDB:
3/14/2008
Entry Details Article
PubMed