タイトル | Exploration of Fragment Binding Poses Leading to Efficient Discovery of Highly Potent and Orally Effective Inhibitors of FABP4 for Anti-inflammation. |
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ジャーナル・号・ページ | J. Med. Chem., Vol. 63, Page 4090-4106, Year 2020 |
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掲載日 | 2019年12月17日 (構造データの登録日) |
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著者 | Su, H. / Zou, Y. / Chen, G. / Dou, H. / Xie, H. / Yuan, X. / Zhang, X. / Zhang, N. / Li, M. / Xu, Y. |
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リンク | J. Med. Chem. / PubMed:32202425 |
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手法 | X線回折 |
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解像度 | 1.4 - 1.75 Å |
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構造データ | PDB-6ljs: Crystal structure of human FABP4 in complex with a novel inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.75 Å PDB-6ljt: Crystal structure of human FABP4 in complex with a novel inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.45 Å PDB-6lju: Crystal structure of human FABP4 in complex with a novel inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.5 Å PDB-6ljv: Crystal structure of human FABP4 in complex with a novel inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.401 Å PDB-6ljw: Crystal structure of human FABP4 in complex with a novel inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.4 Å PDB-6ljx: Crystal structure of human FABP4 in complex with a novel inhibitor 手法: X-RAY DIFFRACTION / 解像度: 1.75 Å |
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化合物 | ChemComp-EH6: 2-[(3-chloranyl-2-phenyl-phenyl)amino]benzoic acid
ChemComp-EHU: 2-[[3-chloranyl-4-(methylamino)-2-phenyl-phenyl]amino]benzoic acid
ChemComp-EHC: 2-[[3-chloranyl-2-(2,3-dihydro-1-benzofuran-5-yl)phenyl]amino]benzoic acid
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由来 | - homo sapiens (ヒト)
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キーワード | LIPID BINDING PROTEIN / FABP4 / inhibitor / complex |
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