Search and Browse
Download
Enter Data
| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Heat shock protein HSP 90-beta | ||
| Ligand | BDBM50361733 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_798935 (CHEMBL1943442) | ||
| IC50 | 14±n/a nM | ||
| Citation |  Baruchello, R; Simoni, D; Grisolia, G; Barbato, G; Marchetti, P; Rondanin, R; Mangiola, S; Giannini, G; Brunetti, T; Alloatti, D; Gallo, G; Ciacci, A; Vesci, L; Castorina, M; Milazzo, FM; Cervoni, ML; Guglielmi, MB; Barbarino, M; Foderà, R; Pisano, C; Cabri, W Novel 3,4-isoxazolediamides as potent inhibitors of chaperone heat shock protein 90. J Med Chem54:8592-604 (2011) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Heat shock protein HSP 90-beta | |||
| Name: | Heat shock protein HSP 90-beta | ||
| Synonyms: | HS90B_HUMAN | HSP 84 | HSP 90 | HSP90AB1 | HSP90B | HSPC2 | HSPCB | Heat Shock Protein 90 (Hsp90) | Heat shock protein HSP 90 (Hsp90) | ||
| Type: | Molecular Chaperone | ||
| Mol. Mass.: | 83229.45 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P08238 | ||
| Residue: | 724 | ||
| Sequence: |
| ||
| BDBM50361733 | |||
| n/a | |||
| Name | BDBM50361733 | ||
| Synonyms: | CHEMBL1940943 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C20H25N3O6 | ||
| Mol. Mass. | 403.429 | ||
| SMILES | CCNC(=O)c1noc(c1NC(=O)C1CC(O)C1)-c1cc(C(C)C)c(O)cc1O |(4.32,.4,;2.78,.4,;2.02,1.74,;.48,1.75,;-.19,3.13,;-.39,.47,;.12,-.98,;-1.1,-1.92,;-2.37,-1.04,;-1.93,.43,;-2.87,1.65,;-4.41,1.69,;-5.21,.37,;-5.15,3.04,;-4.72,4.52,;-6.2,4.95,;-6.94,6.3,;-6.63,3.47,;-3.7,-1.81,;-5.04,-1.05,;-6.36,-1.82,;-7.7,-1.05,;-7.7,.49,;-9.03,-1.82,;-6.37,-3.36,;-7.7,-4.13,;-5.03,-4.14,;-3.7,-3.36,;-2.36,-4.13,)| | ||
| Structure | 
| ||