タイトル | Discovery of a class of highly potent Janus Kinase 1/2 (JAK1/2) inhibitors demonstrating effective cell-based blockade of IL-13 signaling. |
---|
ジャーナル・号・ページ | Bioorg. Med. Chem. Lett., Vol. 29, Page 1522-1531, Year 2019 |
---|
掲載日 | 2018年11月27日 (構造データの登録日) |
---|
著者 | Zak, M. / Hanan, E.J. / Lupardus, P. / Brown, D.G. / Robinson, C. / Siu, M. / Lyssikatos, J.P. / Romero, F.A. / Zhao, G. / Kellar, T. ...Zak, M. / Hanan, E.J. / Lupardus, P. / Brown, D.G. / Robinson, C. / Siu, M. / Lyssikatos, J.P. / Romero, F.A. / Zhao, G. / Kellar, T. / Mendonca, R. / Ray, N.C. / Goodacre, S.C. / Crackett, P.H. / McLean, N. / Hurley, C.A. / Yuen, P.W. / Cheng, Y.X. / Liu, X. / Liimatta, M. / Kohli, P.B. / Nonomiya, J. / Salmon, G. / Buckley, G. / Lloyd, J. / Gibbons, P. / Ghilardi, N. / Kenny, J.R. / Johnson, A. |
---|
リンク | Bioorg. Med. Chem. Lett. / PubMed:30981576 |
---|
手法 | X線回折 |
---|
解像度 | 1.33 - 2.27 Å |
---|
構造データ | PDB-6n77: Structure of the human JAK1 kinase domain with compound 15 手法: X-RAY DIFFRACTION / 解像度: 1.64 Å PDB-6n78: Structure of the human JAK1 kinase domain with compound 21 手法: X-RAY DIFFRACTION / 解像度: 1.83 Å PDB-6n79: Structure of the human JAK1 kinase domain with compound 20 手法: X-RAY DIFFRACTION / 解像度: 2.27 Å PDB-6n7a: Structure of the human JAK1 kinase domain with compound 39 手法: X-RAY DIFFRACTION / 解像度: 1.33 Å PDB-6n7b: Structure of the human JAK1 kinase domain with compound 38 手法: X-RAY DIFFRACTION / 解像度: 1.81 Å PDB-6n7c: Structure of the human JAK1 kinase domain with compound 56 手法: X-RAY DIFFRACTION / 解像度: 1.69 Å PDB-6n7d: Structure of the human JAK1 kinase domain with compound 54 手法: X-RAY DIFFRACTION / 解像度: 1.78 Å |
---|
化合物 | ChemComp-KEJ: N-[3-(5-chloro-2-methoxyphenyl)-1-methyl-1H-pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
ChemComp-KEP: N-{3-[5-chloro-2-(difluoromethoxy)phenyl]-1-methyl-1H-pyrazol-4-yl}pyrazolo[1,5-a]pyrimidine-3-carboxamide
ChemComp-KES: N-{5-[5-chloro-2-(difluoromethoxy)phenyl]-1H-pyrazol-4-yl}pyrazolo[1,5-a]pyrimidine-3-carboxamide
ChemComp-KEV: N-[3-(5-chloro-2-methoxyphenyl)-1-methyl-1H-pyrazol-4-yl]-2-methyl-2H-pyrazolo[4,3-c]pyridine-7-carboxamide
ChemComp-KEY: N-[3-(5-chloro-2-methoxyphenyl)-1-methyl-1H-pyrazol-4-yl]-1H-pyrazolo[4,3-c]pyridine-7-carboxamide
ChemComp-KF1: N-[5-(3-methoxynaphthalen-2-yl)-1H-pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
ChemComp-KF4: N-[5-(6-methoxy-1H-indazol-5-yl)-1H-pyrazol-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
|
---|
由来 | ![](img/tx_human.gif) homo sapiens (ヒト)
|
---|
キーワード | IMMUNE SYSTEM (免疫系) / JAK1 / IL13 / IL-13 / JAK2 / JAK3 / TYK2 |
---|