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Target
Heat shock 70 kDa protein 1A
Ligand
BDBM32370
Substrate
BDBM32369
Meas. Tech.
HSP70 Fluorescence Polarization Assay
pH
7.4±n/a
Temperature
296.15±n/a K
IC50
9400±n/a nM
Citation
 Williamson, DS; Borgognoni, J; Clay, A; Daniels, Z; Dokurno, P; Drysdale, MJ; Foloppe, N; Francis, GL; Graham, CJ; Howes, R; Macias, AT; Murray, JB; Parsons, R; Shaw, T; Surgenor, AE; Terry, L; Wang, Y; Wood, M; Massey, AJ Novel adenosine-derived inhibitors of 70 kDa heat shock protein, discovered through structure-based design. J Med Chem 52:1510-3 (2009) [PubMed]  Article 
Target
Name:
Heat shock 70 kDa protein 1A
Synonyms:
HS71A_HUMAN | HSP70-1/HSP70-2 | HSP70.1 | HSP72 | HSPA1 | HSPA1A | HSX70 | Heat Shock 70kDa Protein 1 | Heat shock 70 kDa protein 1A/1B | Hsp70
Type:
Chaperone
Mol. Mass.:
70043.82
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
641
Sequence:
MAKAAAIGIDLGTTYSCVGVFQHGKVEIIANDQGNRTTPSYVAFTDTERLIGDAAKNQVALNPQNTVFDAKRLIGRKFGDPVVQSDMKHWPFQVINDGDKPKVQVSYKGETKAFYPEEISSMVLTKMKEIAEAYLGYPVTNAVITVPAYFNDSQRQATKDAGVIAGLNVLRIINEPTAAAIAYGLDRTGKGERNVLIFDLGGGTFDVSILTIDDGIFEVKATAGDTHLGGEDFDNRLVNHFVEEFKRKHKKDISQNKRAVRRLRTACERAKRTLSSSTQASLEIDSLFEGIDFYTSITRARFEELCSDLFRSTLEPVEKALRDAKLDKAQIHDLVLVGGSTRIPKVQKLLQDFFNGRDLNKSINPDEAVAYGAAVQAAILMGDKSENVQDLLLLDVAPLSLGLETAGGVMTALIKRNSTIPTKQTQIFTTYSDNQPGVLIQVYEGERAMTKDNNLLGRFELSGIPPAPRGVPQIEVTFDIDANGILNVTATDKSTGKANKITITNDKGRLSKEEIERMVQEAEKYKAEDEVQRERVSAKNALESYAFNMKSAVEDEGLKGKISEADKKKVLDKCQEVISWLDANTLAEKDEFEHKRKELEQVCNPIISGLYQGAGGPGPGGFGAQGPKGGSGSGPTIEEVD
  
Inhibitor
Name:
BDBM32370
Synonyms:
adenosine-derived inhibitor (Grp78), 2 | adenosine-derived inhibitor, 4
Type:
Small organic molecule
Emp. Form.:
C10H14N6O4
Mol. Mass.:
282.256
SMILES:
Nc1nc2c(N)ncnc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r|
Structure:
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Substrate
Name:
BDBM32369
Synonyms:
N6-(6-amino)hexyl-ATP-5-FAM
Type:
fluorescein-labeled ATP-based probe
Emp. Form.:
C38H38N6O18P3
Mol. Mass.:
959.6607
SMILES:
O[C@@H]1[C@@H](COP([O-])(=O)OP([O-])(=O)OP(O)([O-])=O)O[C@H]([C@@H]1O)n1cnc2c(NCCCCCCNC(=O)c3ccc4c(c3)C(=O)OC43c4ccc(O)cc4Cc4cc(O)ccc34)ncnc12 |r|
Structure:
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