Reaction Details | |||
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Target | Endoplasmin | ||
Ligand | BDBM210941 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | Fluorescence Polarization (FP) Assay | ||
pH | 7.3±n/a | ||
Kd | 9.43e+3± 2.6e+2 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 | ||
Endoplasmin | |||
Name: | Endoplasmin | ||
Synonyms: | 94 kDa glucose-regulated protein | ENPL_HUMAN | GRP-94 | GRP94 | Glucose regulated protein 94kDa (Grp94) | HSP90B1 | Heat shock protein 90 kDa beta member 1 | TRA1 | Tumor rejection antigen 1 | gp96 homolog | ||
Type: | Protein | ||
Mol. Mass.: | 92417.36 | ||
Organism: | Homo sapiens (Human) | ||
Description: | P14625 | ||
Residue: | 803 | ||
Sequence: |
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BDBM210941 | |||
n/a | |||
Name | BDBM210941 | ||
Synonyms: | 2-(((1r,4r)-4-hydroxycyclohexyl)amino)-4-(2-(m-tolyl)-1H-pyrrol-1-yl)benzamide (5c) | US10975030, Compound 5c | ||
Type | Small organic molecule | ||
Emp. Form. | C24H27N3O2 | ||
Mol. Mass. | 389.4901 | ||
SMILES | Cc1cccc(c1)-c1cccn1-c1ccc(C(N)=O)c(NC2CCC(O)CC2)c1 |(2.99,2.71,;3.31,1.21,;2.16,.18,;2.48,-1.33,;3.95,-1.8,;5.09,-.77,;4.77,.73,;6.56,-1.25,;7.03,-2.71,;8.57,-2.71,;9.05,-1.25,;7.8,-.34,;7.8,1.2,;6.47,1.97,;6.47,3.51,;7.8,4.28,;7.8,5.82,;9.14,6.59,;6.47,6.59,;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,;9.14,1.97,)| | ||
Structure |