Reaction Details | |||
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Target | Heat shock protein HSP 90-alpha | ||
Ligand | BDBM210966 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | Fluorescence Polarization (FP) Assay | ||
pH | 7.3±n/a | ||
Kd | >1.00e+5±n/a nM | ||
Comments | extracted | ||
Citation | Mishra, SJ; Ghosh, S; Stothert, AR; Dickey, CA; Blagg, BS Transformation of the Non-Selective Aminocyclohexanol-Based Hsp90 Inhibitor into a Grp94-Seletive Scaffold. ACS Chem Biol12:244-253 (2017) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Heat shock protein HSP 90-alpha | |||
Name: | Heat shock protein HSP 90-alpha | ||
Synonyms: | HS90A_HUMAN | HSP 86 | HSP86 | HSP90A | HSP90AA1 | HSPC1 | HSPCA | Heat Shock Protein 90 (Hsp90) | Heat shock 86 kDa | Heat shock protein HSP 90 (HSP90) | Heat shock protein HSP 90-alpha (HSP90) | Heat shock protein HSP 90-alpha (HSP90A) | LAP-2 | LPS-associated protein 2 | Lipopolysaccharide-associated protein 2 | Renal carcinoma antigen NY-REN-38 | heat shock protein 90kDa alpha (cytosolic), class A member 1 isoform 2 | ||
Type: | Molecular Chaperone | ||
Mol. Mass.: | 84623.45 | ||
Organism: | Homo sapiens (Human) | ||
Description: | P07900 | ||
Residue: | 732 | ||
Sequence: |
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BDBM210966 | |||
n/a | |||
Name | BDBM210966 | ||
Synonyms: | 2-(((1r,4r)-4-hydroxycyclohexyl)amino)-4-(2-(pyridin-4-ylmethyl)-1H-pyrrol-1-yl)benzamide (8q) | US10975030, Compound 8q | ||
Type | Small organic molecule | ||
Emp. Form. | C23H26N4O2 | ||
Mol. Mass. | 390.4781 | ||
SMILES | NC(=O)c1ccc(cc1NC1CCC(O)CC1)-n1cccc1Cc1ccncc1 |(9.14,6.59,;7.8,5.82,;6.47,6.59,;7.8,4.28,;6.47,3.51,;6.47,1.97,;7.8,1.2,;9.14,1.97,;9.14,3.51,;10.47,4.28,;11.8,3.51,;13.14,4.28,;14.47,3.51,;14.47,1.97,;15.8,1.2,;13.14,1.2,;11.8,1.97,;7.8,-.34,;6.56,-1.25,;7.03,-2.71,;8.57,-2.71,;9.05,-1.25,;10.51,-.77,;11.66,-1.8,;11.34,-3.31,;12.48,-4.34,;13.95,-3.87,;14.27,-2.36,;13.12,-1.33,)| | ||
Structure |