| タイトル | Discovery of a Highly Selective and H435R-Sensitive Thyroid Hormone Receptor beta Agonist. |
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| ジャーナル・号・ページ | J. Med. Chem., Vol. 65, Page 7193-7211, Year 2022 |
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| 掲載日 | 2022年1月14日 (構造データの登録日) |
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著者 | Li, Q. / Yao, B. / Zhao, S. / Lu, Z. / Zhang, Y. / Xiang, Q. / Wu, X. / Yu, H. / Zhang, C. / Li, J. ...Li, Q. / Yao, B. / Zhao, S. / Lu, Z. / Zhang, Y. / Xiang, Q. / Wu, X. / Yu, H. / Zhang, C. / Li, J. / Zhuang, X. / Wu, D. / Li, Y. / Xu, Y. |
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リンク | J. Med. Chem. / PubMed:35507418 |
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| 手法 | X線回折 |
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| 解像度 | 1.97 - 2.93 Å |
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| 構造データ | PDB-7wlx: A novel chemical derivative(53) of THRB agonist 手法: X-RAY DIFFRACTION / 解像度: 2.39 Å PDB-7wmg: A novel chemical derivative(52) of THRB agonist 手法: X-RAY DIFFRACTION / 解像度: 2.93 Å PDB-7wmh: A novel chemical derivative(56) of THRB agonist 手法: X-RAY DIFFRACTION / 解像度: 1.97 Å PDB-7wmj: A novel chemical derivative(71) of THRB agonist 手法: X-RAY DIFFRACTION / 解像度: 2.81 Å PDB-7wml: A novel chemical derivative(85) of THRB agonist 手法: X-RAY DIFFRACTION / 解像度: 2.67 Å PDB-7wmn: A novel chemical derivative(89) of THRB agonist 手法: X-RAY DIFFRACTION / 解像度: 2.57 Å PDB-7wmo: A novel chemical derivative(92) of THRB agonist 手法: X-RAY DIFFRACTION / 解像度: 2.56 Å |
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| 化合物 | ChemComp-9GC: 2-[[1-methoxy-4-oxidanyl-7-[4-(phenylmethyl)phenoxy]isoquinolin-3-yl]carbonylamino]ethanoic acid
ChemComp-9IF: 2-[[1-methoxy-4-oxidanyl-7-(4-phenoxyphenoxy)isoquinolin-3-yl]carbonylamino]ethanoic acid
ChemComp-9II: 2-[[1-methoxy-4-oxidanyl-7-(4-phenylphenoxy)isoquinolin-3-yl]carbonylamino]ethanoic acid
ChemComp-9IL: 2-[[7-[2,6-dimethyl-4-(phenylcarbonyl)phenoxy]-1-methoxy-4-oxidanyl-isoquinolin-3-yl]carbonylamino]ethanoic acid
ChemComp-9IQ: 2-[[7-[4-(3,5-dimethylphenyl)carbonyl-2,6-dimethyl-phenoxy]-1-ethoxy-4-oxidanyl-isoquinolin-3-yl]carbonylamino]ethanoic acid
ChemComp-9IT: 2-[[7-[2,6-dimethyl-4-(3-methylphenyl)carbonyl-phenoxy]-1-methoxy-4-oxidanyl-isoquinolin-3-yl]carbonylamino]ethanoic acid
ChemComp-9IW: 2-[[1-ethoxy-7-[4-(3-fluoranyl-5-methoxy-phenyl)carbonyl-2,6-dimethyl-phenoxy]-4-oxidanyl-isoquinolin-3-yl]carbonylamino]ethanoic acid
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| 由来 | homo sapiens (ヒト)
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キーワード | TRANSCRIPTION / Transcription factor / ligand. / ligand |
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