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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Estrogen receptor | ||
| Ligand | BDBM50238734 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1664056 (CHEMBL4013737) | ||
| Ki | 1.7±n/a nM | ||
| Citation |  Min, J; Guillen, VS; Sharma, A; Zhao, Y; Ziegler, Y; Gong, P; Mayne, CG; Srinivasan, S; Kim, SH; Carlson, KE; Nettles, KW; Katzenellenbogen, BS; Katzenellenbogen, JA Adamantyl Antiestrogens with Novel Side Chains Reveal a Spectrum of Activities in Suppressing Estrogen Receptor Mediated Activities in Breast Cancer Cells. J Med Chem60:6321-6336 (2017) [PubMed] Article | ||
| 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: |
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| BDBM50238734 | |||
| n/a | |||
| Name | BDBM50238734 | ||
| Synonyms: | CHEMBL4101656 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C31H36O2 | ||
| Mol. Mass. | 440.6163 | ||
| SMILES | CCCCCC(=O)\C=C\c1ccc(cc1)C(=C1C2CC3CC(C2)CC1C3)c1ccc(O)cc1 |TLB:15:16:18:22.20.21,THB:20:19:16:22.21.23,20:21:18.19.25:16,23:21:18:25.24.16,23:24:18:22.20.21,(20.65,-10.04,;21.99,-10.82,;23.32,-10.05,;24.66,-10.82,;25.99,-10.05,;27.32,-10.82,;27.32,-12.36,;28.66,-10.05,;29.99,-10.82,;31.32,-10.05,;31.33,-8.51,;32.65,-7.74,;33.99,-8.5,;34,-10.05,;32.66,-10.82,;35.32,-7.73,;36.66,-8.49,;36.67,-9.98,;35.47,-11.25,;36.96,-10.84,;38.38,-11.4,;39.38,-10.12,;37.99,-10.47,;39.4,-8.59,;38,-8.02,;36.96,-9.25,;35.32,-6.19,;36.65,-5.42,;36.64,-3.88,;35.31,-3.12,;35.3,-1.58,;33.97,-3.9,;33.98,-5.44,)| | ||
| Structure | 
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