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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Estrogen receptor | ||
| Ligand | BDBM269469 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ERalpha Degradation (MCF7 Cells) | ||
| pH | 7.4±n/a | ||
| Temperature | 298.15±n/a K | ||
| IC50 | 1.40±n/a nM | ||
| Comments | extracted | ||
| Citation |  Burks, HE; Dechantsreiter, MA; He, G; Nunez, J; Peukert, S; Springer, C; Sun, Y; Thomsen, NM; Tria, GS; Yu, B Benzothiophene derivatives and compositions thereof as selective estrogen receptor degraders US Patent US10058534 Publication Date 8/28/2018 | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Estrogen receptor | |||
| Name: | Estrogen receptor | ||
| Synonyms: | ER | ER-alpha | ESR | ESR1 | ESR1_HUMAN | Estradiol receptor | Estrogen receptor | Estrogen receptor (ER alpha) | Estrogen receptor (ER-alpha) | Estrogen receptor alpha (ER alpha) | Estrogen receptor alpha (ER) | NR3A1 | Nuclear receptor subfamily 3 group A member 1 | ||
| Type: | Protein | ||
| Mol. Mass.: | 66230.44 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P03372 | ||
| Residue: | 595 | ||
| Sequence: |
| ||
| BDBM269469 | |||
| n/a | |||
| Name | BDBM269469 | ||
| Synonyms: | (E)-3-(4-((6-hydroxy-2- (2-isopropyl-6- methylphenyl)benzo[b] thiophen-3- yl)oxy)phenyl)acrylic acid | US10058534, 124 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C27H24O4S | ||
| Mol. Mass. | 444.542 | ||
| SMILES | CC(C)c1cccc(C)c1-c1sc2cc(O)ccc2c1Oc1ccc(\C=C\C(O)=O)cc1 |(1.29,-7.98,;1.29,-6.44,;-.04,-5.67,;2.63,-5.67,;3.96,-6.44,;5.3,-5.67,;5.3,-4.13,;3.96,-3.36,;3.96,-1.82,;2.63,-4.13,;1.22,-3.5,;-.03,-4.41,;-1.27,-3.5,;-2.78,-3.82,;-3.81,-2.68,;-5.3,-3.08,;-3.33,-1.21,;-1.83,-.89,;-.8,-2.04,;.74,-2.04,;1.83,-.95,;1.44,.54,;2.52,1.63,;2.13,3.12,;.64,3.51,;.24,5,;-1.25,5.4,;-1.65,6.89,;-3.13,7.29,;-.56,7.98,;-.45,2.43,;-.05,.94,)| | ||
| Structure | 
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