Reaction Details | |||
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Target | Estrogen receptor | ||
Ligand | BDBM50238732 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_1664056 (CHEMBL4013737) | ||
Ki | 3.3±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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BDBM50238732 | |||
n/a | |||
Name | BDBM50238732 | ||
Synonyms: | CHEMBL4082698 | ||
Type | Small organic molecule | ||
Emp. Form. | C28H30O3 | ||
Mol. Mass. | 414.536 | ||
SMILES | CCOC(=O)\C=C\c1ccc(cc1)C(=C1C2CC3CC(C2)CC1C3)c1ccc(O)cc1 |TLB:13:14:16:20.18.19,THB:18:17:14:20.19.21,18:19:16.17.23:14,21:19:16:23.22.14,21:22:16:20.18.19,(22.69,-38.82,;24.03,-39.59,;25.36,-38.82,;26.69,-39.59,;26.69,-41.13,;28.03,-38.82,;29.36,-39.59,;30.7,-38.83,;30.7,-37.28,;32.03,-36.51,;33.36,-37.27,;33.37,-38.82,;32.03,-39.6,;34.69,-36.5,;36.03,-37.26,;36.04,-38.76,;34.84,-40.03,;36.33,-39.61,;37.75,-40.17,;38.75,-38.89,;37.36,-39.24,;38.77,-37.36,;37.37,-36.79,;36.33,-38.02,;34.69,-34.96,;36.02,-34.19,;36.02,-32.65,;34.68,-31.89,;34.67,-30.35,;33.34,-32.67,;33.36,-34.21,)| | ||
Structure |