PDB: 2360 件ウェブページステータス検索Chemie searchBIRD

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6DUD	JAK3 with cyanamide CP12 分子名称: N-[(1S)-6-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-2,3-dihydro-1H-inden-1-yl]imidoformamide, SULFATE ION, Tyrosine-protein kinase JAK3 著者 Vajdos, F.F. 登録日 2018-06-20 公開日 2018-11-28 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (1.66 Å) 主引用文献 Identification of Cyanamide-Based Janus Kinase 3 (JAK3) Covalent Inhibitors. J. Med. Chem., 61, 2018
3P86	Crystal structure of CTR1 kinase domain mutant D676N in complex with staurosporine 分子名称: STAUROSPORINE, Serine/threonine-protein kinase CTR1 著者 Mayerhofer, H, Panneerselvam, S, Mueller-Dieckmann, J. 登録日 2010-10-13 公開日 2011-10-26 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (2.496 Å) 主引用文献 Protein kinase domain of CTR1 from Arabidopsis thaliana promotes ethylene receptor cross talk. J. Mol. Biol., 415, 2012
6DB4	JAK3 with Cyanamide CP34 分子名称: N-[(1S)-6-(5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-2,3-dihydro-1H-inden-1-yl]imidoformamide, Tyrosine-protein kinase JAK3 著者 Vajdos, F.F. 登録日 2018-05-02 公開日 2018-11-28 最終更新日 2019-05-01 実験手法 X-RAY DIFFRACTION (1.662 Å) 主引用文献 Identification of Cyanamide-Based Janus Kinase 3 (JAK3) Covalent Inhibitors. J. Med. Chem., 61, 2018
6DI0	CRYSTAL STRUCTURE OF BTK IN COMPLEX WITH FRAGMENT LIGAND 分子名称: 6-(cyclohexylamino)pyridine-3-carboxamide, Tyrosine-protein kinase BTK 著者 MOCHALKIN, I. 登録日 2018-05-22 公開日 2018-10-17 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (1.3 Å) 主引用文献 Discovery of a novel series of pyridine and pyrimidine carboxamides as potent and selective covalent inhibitors of Btk. Bioorg. Med. Chem. Lett., 28, 2018
6DI5	CRYSTAL STRUCTURE OF BTK IN COMPLEX WITH COVALENT INHIBITOR 分子名称: 2-(4-phenoxyphenoxy)-6-[(1S,4S)-5-propanoyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]pyridine-3-carboxamide, DIMETHYL SULFOXIDE, Tyrosine-protein kinase BTK 著者 Gardberg, A. 登録日 2018-05-22 公開日 2018-09-05 実験手法 X-RAY DIFFRACTION (1.42 Å) 主引用文献 Discovery of potent, highly selective covalent irreversible BTK inhibitors from a fragment hit. Bioorg. Med. Chem. Lett., 28, 2018
6D8E	Discovery of a Highly Potent and Broadly Effective EGFR and HER2 Exon 20 Insertion Mutant Inhibitor 分子名称: (4-fluorophenyl)methyl {2-[(1-methyl-1H-pyrazol-3-yl)amino]pyrimidin-4-yl}[3-(propanoylamino)phenyl]carbamate, Epidermal growth factor receptor 著者 Park, E, Eck, M.J. 登録日 2018-04-26 公開日 2018-07-18 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.537 Å) 主引用文献 Discovery of a Highly Potent and Broadly Effective Epidermal Growth Factor Receptor and HER2 Exon 20 Insertion Mutant Inhibitor. Angew. Chem. Int. Ed. Engl., 57, 2018
6DA4	JAK3 with Cyanamide CP10 分子名称: (Z)-1-{2,2-difluoro-6-[5-(2-methoxyethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-2,3-dihydro-4H-1,4-benzoxazin-4-yl}methanimine, Tyrosine-protein kinase JAK3 著者 Vajdos, F.F. 登録日 2018-05-01 公開日 2018-11-28 最終更新日 2019-05-01 実験手法 X-RAY DIFFRACTION (2.9 Å) 主引用文献 Identification of Cyanamide-Based Janus Kinase 3 (JAK3) Covalent Inhibitors. J. Med. Chem., 61, 2018
3PJ1	Crystal structure of BTK kinase domain complexed with 3-(2,6-Dichloro-phenyl)-7-[4-(2-diethylamino-ethoxy)-phenylamino]-1-methyl-3,4-dihydro-1H-pyrimido[4,5-d]pyrimidin-2-one 分子名称: 3-(2,6-dichlorophenyl)-7-({4-[2-(diethylamino)ethoxy]phenyl}amino)-1-methyl-3,4-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one, Tyrosine-protein kinase BTK 著者 Kuglstatter, A, Wong, A. 登録日 2010-11-08 公開日 2011-01-12 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Insights into the conformational flexibility of Bruton's tyrosine kinase from multiple ligand complex structures. Protein Sci., 20, 2011
6UBW	MET Tyrosine Kinase Inhibition Enhances the Antitumor Efficacy of an HGF Antibody 分子名称: CHLORIDE ION, Hepatocyte growth factor receptor, N-(6-{difluoro[6-(1-methyl-1H-pyrazol-4-yl)[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}imidazo[1,2-b]pyridazin-2-yl)cyclopropanecarboxamide 著者 Hoffman, I.D, Lawson, J.D. 登録日 2019-09-13 公開日 2020-02-12 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 MET Tyrosine Kinase Inhibition Enhances the Antitumor Efficacy of an HGF Antibody. Mol.Cancer Ther., 16, 2017
3PRF	Crystal Structure of Human B-Raf Kinase Domain in Complex with a Non-Oxime Furopyridine Inhibitor 分子名称: 2-chloro-5-{[2-(pyrimidin-2-yl)furo[2,3-c]pyridin-3-yl]amino}phenol, Serine/threonine-protein kinase B-raf 著者 Voegtli, W.C, Vigers, G.P.A, Morales, T, Brandhuber, B.J. 登録日 2010-11-29 公開日 2011-02-02 最終更新日 2024-02-21 実験手法 X-RAY DIFFRACTION (2.9 Å) 主引用文献 Non-oxime inhibitors of B-Raf(V600E) kinase. Bioorg.Med.Chem.Lett., 21, 2011
3PRI	Crystal Structure of Human B-Raf Kinase in Complex with a Non-Oxime Furopyridine Inhibitor 分子名称: 3-(4-{[2-(pyrimidin-2-yl)furo[2,3-c]pyridin-3-yl]amino}-1H-indazol-3-yl)propan-1-ol, Serine/threonine-protein kinase B-raf 著者 Voegtli, W.C, Vigers, G.P.A, Morales, T, Brandhuber, B.J. 登録日 2010-11-29 公開日 2011-02-02 最終更新日 2024-02-21 実験手法 X-RAY DIFFRACTION (3.5 Å) 主引用文献 Non-oxime inhibitors of B-Raf(V600E) kinase. Bioorg.Med.Chem.Lett., 21, 2011
3PSD	Non-oxime pyrazole based inhibitors of B-Raf kinase 分子名称: 6-[1-(piperidin-4-yl)-3-(pyridin-4-yl)-1H-pyrazol-4-yl]indeno[1,2-c]pyrazole, B-RAF PROTO-ONCOGENE SERINE/THREONINE-PROTEIN KINASE 著者 Morales, T, Vigers, G.P.A, Brandhuber, B.J. 登録日 2010-12-01 公開日 2011-05-18 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (3.6 Å) 主引用文献 Non-oxime pyrazole based inhibitors of B-Raf kinase. Bioorg.Med.Chem.Lett., 21, 2011
6DRW	JAK2 JH1 in complex with JNJ-7706621 (Crystal Form 2) 分子名称: 4-({5-amino-1-[(2,6-difluorophenyl)carbonyl]-1H-1,2,4-triazol-3-yl}amino)benzenesulfonamide, Tyrosine-protein kinase JAK2 著者 Puleo, D.E, Schlessinger, J. 登録日 2018-06-13 公開日 2018-07-18 最終更新日 2023-11-15 実験手法 X-RAY DIFFRACTION (2.303 Å) 主引用文献 JAK2 JH2 Binders To Be Published
6DKW	Crystal structure of Trk-A in complex with the Pan-Trk Kinase Inhibitor, compound 3. 分子名称: 5-(1-methyl-1H-imidazol-4-yl)-2-[(1-{[4-(trifluoromethoxy)phenyl]acetyl}piperidin-4-yl)oxy]benzamide, Tyrosine-protein kinase receptor 著者 Greasley, S.E, Brown, D. 登録日 2018-05-31 公開日 2018-07-11 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (2.91 Å) 主引用文献 Discovery of Potent, Selective, and Peripherally Restricted Pan-Trk Kinase Inhibitors for the Treatment of Pain. J. Med. Chem., 61, 2018
3QLG	Crystal structure of the L317I mutant of the C-src tyrosine kinase domain complexed with dasatinib 分子名称: N-(2-CHLORO-6-METHYLPHENYL)-2-({6-[4-(2-HYDROXYETHYL)PIPERAZIN-1-YL]-2-METHYLPYRIMIDIN-4-YL}AMINO)-1,3-THIAZOLE-5-CARBOXAMIDE, Proto-oncogene tyrosine-protein kinase Src 著者 Boubeva, R, Pernot, L, Perozzo, R, Scapozza, L. 登録日 2011-02-02 公開日 2012-02-08 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (2.75 Å) 主引用文献 A single amino-acid dictates the dynamics of the switch between active and inactive C-src conformation To be Published
6UMW	Crystal structure of hEphB1 bound with chlortetracycline 分子名称: 7-CHLOROTETRACYCLINE, Ephrin type-B receptor 1 著者 Ahmed, M, Wang, P, Sadek, H. 登録日 2019-10-10 公開日 2020-10-14 最終更新日 2023-11-15 実験手法 X-RAY DIFFRACTION (1.982 Å) 主引用文献 Identification of tetracycline combinations as EphB1 tyrosine kinase inhibitors for treatment of neuropathic pain. Proc.Natl.Acad.Sci.USA, 118, 2021
6E4F	Crystal structure of ARQ 531 in complex with the kinase domain of BTK 分子名称: 1,2-ETHANEDIOL, 1,5-anhydro-2-{[5-(2-chloro-4-phenoxybenzene-1-carbonyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino}-2,3,4-trideoxy-D-erythro-hexitol, IMIDAZOLE, ... 著者 Eathiraj, S. 登録日 2018-07-17 公開日 2018-09-05 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (1.15 Å) 主引用文献 The BTK Inhibitor ARQ 531 Targets Ibrutinib-Resistant CLL and Richter Transformation. Cancer Discov, 8, 2018
3PIX	Crystal structure of BTK kinase domain complexed with 2-Isopropyl-7-(4-methyl-piperazin-1-yl)-4-(5-methyl-2H-pyrazol-3-ylamino)-2H-phthalazin-1-one 分子名称: 7-(4-methylpiperazin-1-yl)-4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-(propan-2-yl)phthalazin-1(2H)-one, Tyrosine-protein kinase BTK 著者 Kuglstatter, A, Wong, A. 登録日 2010-11-08 公開日 2011-01-12 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 Insights into the conformational flexibility of Bruton's tyrosine kinase from multiple ligand complex structures. Protein Sci., 20, 2011
3PJ2	Crystal structure of BTK kinase domain complexed with 2-[4-(2-Diethylamino-ethoxy)-phenylamino]-6-(4-fluoro-phenoxy)-8-methyl-8H-pyrido[2,3-d]pyrimidin-7-one 分子名称: 2-({4-[2-(diethylamino)ethoxy]phenyl}amino)-6-(4-fluorophenoxy)-8-methylpyrido[2,3-d]pyrimidin-7(8H)-one, Tyrosine-protein kinase BTK 著者 Kuglstatter, A, Wong, A. 登録日 2010-11-08 公開日 2011-01-12 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (1.75 Å) 主引用文献 Insights into the conformational flexibility of Bruton's tyrosine kinase from multiple ligand complex structures. Protein Sci., 20, 2011
3PSB	Furo[2,3-c]pyridine-based Indanone Oximes as Potent and Selective B-Raf Inhibitors 分子名称: B-RAF PROTO-ONCOGENE SERINE/THREONINE-PROTEIN KINASE, ethyl 3-{[1-(hydroxyamino)-2H-inden-5-yl]amino}thieno[2,3-c]pyridine-2-carboxylate 著者 Morales, T, Vigers, G.P.A, Brandhuber, B.J. 登録日 2010-12-01 公開日 2011-01-19 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (3.4 Å) 主引用文献 The Discovery of furo[2,3-c]pyridine-based indanone oximes as potent and selective B-Raf inhibitors. Bioorg.Med.Chem.Lett., 21, 2011
6EDL	hALK in complex with compound 1 (S)-N-(1-(2,4-difluorophenyl)ethyl)-3-(3-methyl-1H-pyrazol-5-yl)imidazo[1,2-b]pyridazin-6-amine 分子名称: ALK tyrosine kinase receptor, N-[(1S)-1-(2,4-difluorophenyl)ethyl]-3-(5-methyl-1H-pyrazol-3-yl)imidazo[1,2-b]pyridazin-6-amine 著者 Lane, W, Saikatendu, K. 登録日 2018-08-09 公開日 2019-05-01 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (2.799 Å) 主引用文献 Discovery of Potent, Selective, and Brain-Penetrant 1 H-Pyrazol-5-yl-1 H-pyrrolo[2,3- b]pyridines as Anaplastic Lymphoma Kinase (ALK) Inhibitors. J.Med.Chem., 62, 2019
6EGA	IRAK4 in complex with a type II inhibitor 分子名称: 3-{2-[(cyclopropanecarbonyl)amino][1,3]thiazolo[5,4-b]pyridin-5-yl}-N-{4-[(piperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl}benzamide, COBALT (II) ION, Interleukin-1 receptor-associated kinase 4, ... 著者 Wang, L, Wu, H. 登録日 2018-08-19 公開日 2019-02-20 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (2.512 Å) 主引用文献 Conformational flexibility and inhibitor binding to unphosphorylated interleukin-1 receptor-associated kinase 4 (IRAK4). J.Biol.Chem., 294, 2019
3PIY	Crystal structure of BTK kinase domain complexed with R406 分子名称: 6-({5-fluoro-2-[(3,4,5-trimethoxyphenyl)amino]pyrimidin-4-yl}amino)-2,2-dimethyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one, Tyrosine-protein kinase BTK 著者 Kuglstatter, A, Wong, A. 登録日 2010-11-08 公開日 2011-01-12 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (2.55 Å) 主引用文献 Insights into the conformational flexibility of Bruton's tyrosine kinase from multiple ligand complex structures. Protein Sci., 20, 2011
6EAS	Co-crystal of pseudokinase DRIK1 (drought responsive inactive kinase 1) bound to ENMD-2076 分子名称: 6-(4-methylpiperazin-1-yl)-N-(5-methyl-1H-pyrazol-3-yl)-2-[(E)-2-phenylethenyl]pyrimidin-4-amine, GLYCEROL, drought responsive inactive kinase 1 著者 Aquino, B, Counago, R.M, Fala, A.M, Massirer, K.B, Elkins, J.M, Arruda, P, Structural Genomics Consortium (SGC) 登録日 2018-08-03 公開日 2018-08-22 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Co-crystal of pseudokinase DRIK1 with ENMD-2076 To be Published
6CAD	Crystal structure of RAF kinase domain bound to the inhibitor 2a 分子名称: 1-(propan-2-yl)-3-({3-[3-(trifluoromethyl)phenyl]isoquinolin-8-yl}ethynyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine, Serine/threonine-protein kinase B-raf 著者 Maisonneuve, P, Kurinov, I, Assadieskandar, A, Yu, C, Liu, X, Chen, Y.-C, Prakash, G.K.S, Zhang, C, SIcheri, F. 登録日 2018-01-30 公開日 2018-02-21 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.55 Å) 主引用文献 Effects of rigidity on the selectivity of protein kinase inhibitors. Eur J Med Chem, 146, 2018

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