Reaction Details |
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Target | Heat shock 70 kDa protein 1A |
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Ligand | BDBM32378 |
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Substrate/Competitor | BDBM32369 |
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Meas. Tech. | HSP70 Fluorescence Polarization Assay |
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pH | 7.4±n/a |
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Temperature | 296.15±n/a K |
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IC50 | 500±n/a nM |
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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 Chem52:1510-3 (2009) [PubMed] Article |
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More Info.: | Get all data from this article, Inhibition_Run data, Solution Info, Assay Method |
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Heat shock 70 kDa protein 1A |
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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: | MAKAAAIGIDLGTTYSCVGVFQHGKVEIIANDQGNRTTPSYVAFTDTERLIGDAAKNQVA
LNPQNTVFDAKRLIGRKFGDPVVQSDMKHWPFQVINDGDKPKVQVSYKGETKAFYPEEIS
SMVLTKMKEIAEAYLGYPVTNAVITVPAYFNDSQRQATKDAGVIAGLNVLRIINEPTAAA
IAYGLDRTGKGERNVLIFDLGGGTFDVSILTIDDGIFEVKATAGDTHLGGEDFDNRLVNH
FVEEFKRKHKKDISQNKRAVRRLRTACERAKRTLSSSTQASLEIDSLFEGIDFYTSITRA
RFEELCSDLFRSTLEPVEKALRDAKLDKAQIHDLVLVGGSTRIPKVQKLLQDFFNGRDLN
KSINPDEAVAYGAAVQAAILMGDKSENVQDLLLLDVAPLSLGLETAGGVMTALIKRNSTI
PTKQTQIFTTYSDNQPGVLIQVYEGERAMTKDNNLLGRFELSGIPPAPRGVPQIEVTFDI
DANGILNVTATDKSTGKANKITITNDKGRLSKEEIERMVQEAEKYKAEDEVQRERVSAKN
ALESYAFNMKSAVEDEGLKGKISEADKKKVLDKCQEVISWLDANTLAEKDEFEHKRKELE
QVCNPIISGLYQGAGGPGPGGFGAQGPKGGSGSGPTIEEVD
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BDBM32378 |
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BDBM32369 |
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Name | BDBM32378 |
Synonyms: | adenosine-derived inhibitor (Grp78), 13 | adenosine-derived inhibitor, 12 |
Type | Small organic molecule |
Emp. Form. | C25H23Cl2N7O4 |
Mol. Mass. | 556.401 |
SMILES | Nc1ncnc2n([C@@H]3O[C@H](COCc4ccc(cc4)C#N)[C@@H](O)[C@H]3O)c(NCc3ccc(Cl)c(Cl)c3)nc12 |r| |
Structure |
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