Brief Information of the Compound and Protein
Compound Name
2-amino-6-halopurine analogue, 20
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PubChem ID
CID: 16736529
SID: 26694745
Canonical SMILES
COc1c(C)cnc(Cn2cnc3c(Cl)nc(N)nc23)c1C
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Compound Formula C14H15ClN6O
Compound Structure
Protein Name
Heat shock protein HSP 90-alpha
Protein Classification
Other cytosolic protein
Uniprot ID
P07900
Gene Name
HSP90AA1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000083 MCF-7 Homo sapiens (Human)  1
1
EC50 = 38 nM
   TI
   LI
   LO
   TS
CL000013 Sf9 Spodoptera frugiperda (Fall armyworm)  1
1
Ki = 2 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 5.1 nM
2 IC50 = 19 nM
3 IC50 = 29 nM
4 IC50 = 52 nM
5 IC50 = 65.7 nM
6 Ki = 1.7 nM