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Optimization of Orally Bioavailable Enhancer of Zeste Homolog 2 (EZH2) Inhibitors Using Ligand and Property-Based Design Strategies: Identification of Development Candidate (R)-5,8-Dichloro-7-(methoxy(oxetan-3-yl)methyl)-2-((4-methoxy-6-methyl-2-oxo-1,2-dihydropyridin-3-yl)methyl)-3,4-dihydroisoquinolin-1(2H)-one (PF-06821497).
J Med Chem. 2018 Feb 8;61(3):650-665. doi: 10.1021/acs.jmedchem.7b01375. Epub 2017 Dec 27.
J Med Chem. 2018.
PMID: 29211475
SAH derived potent and selective EZH2 inhibitors.
Kung PP, Huang B, Zehnder L, Tatlock J, Bingham P, Krivacic C, Gajiwala K, Diehl W, Yu X, Maegley KA.
Kung PP, et al. Among authors: krivacic c.
Bioorg Med Chem Lett. 2015 Apr 1;25(7):1532-7. doi: 10.1016/j.bmcl.2015.02.017. Epub 2015 Feb 17.
Bioorg Med Chem Lett. 2015.
PMID: 25746813
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Design and Synthesis of Pyridone-Containing 3,4-Dihydroisoquinoline-1(2H)-ones as a Novel Class of Enhancer of Zeste Homolog 2 (EZH2) Inhibitors.
Kung PP, Rui E, Bergqvist S, Bingham P, Braganza J, Collins M, Cui M, Diehl W, Dinh D, Fan C, Fantin VR, Gukasyan HJ, Hu W, Huang B, Kephart S, Krivacic C, Kumpf RA, Li G, Maegley KA, McAlpine I, Nguyen L, Ninkovic S, Ornelas M, Ryskin M, Scales S, Sutton S, Tatlock J, Verhelle D, Wang F, Wells P, Wythes M, Yamazaki S, Yip B, Yu X, Zehnder L, Zhang WG, Rollins RA, Edwards M.
Kung PP, et al. Among authors: krivacic c.
J Med Chem. 2016 Sep 22;59(18):8306-25. doi: 10.1021/acs.jmedchem.6b00515. Epub 2016 Sep 6.
J Med Chem. 2016.
PMID: 27512831
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Correction to Design and Synthesis of Pyridone-Containing 3,4-Dihydroisoquinoline-1(2H)-ones as a Novel Class of Enhancer of Zeste Homolog 2 (EZH2) Inhibitors.
Kung PP, Rui E, Bergqvist S, Bingham P, Braganza J, Collins M, Cui M, Diehl W, Dinh D, Fan C, Fantin VR, Gukasyan HJ, Hu W, Huang B, Kephart S, Krivacic C, Kumpf RA, Li G, Maegley KA, McAlpine I, Nguyen L, Ninkovic S, Ornelas M, Ryskin M, Scales S, Sutton S, Tatlock J, Verhelle D, Wang F, Wells P, Wythes M, Yamazaki S, Yip B, Yu X, Zehnder L, Zhang WG, Rollins RA, Edwards M.
Kung PP, et al. Among authors: krivacic c.
J Med Chem. 2016 Dec 22;59(24):11196. doi: 10.1021/acs.jmedchem.6b01747. Epub 2016 Dec 12.
J Med Chem. 2016.
PMID: 27936698
No abstract available.
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Comparison of a High-Throughput Mass Spectrometry Method and Radioactive Filter Binding to Assay the Protein Methyltransferase PRMT5.
Maegley KA, Krivacic C, Bingham P, Liu W, Brooun A.
Maegley KA, et al. Among authors: krivacic c.
Assay Drug Dev Technol. 2015 May;13(4):235-40. doi: 10.1089/adt.2015.640.
Assay Drug Dev Technol. 2015.
PMID: 26065559
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Computational design of a modular protein sense-response system.
Glasgow AA, Huang YM, Mandell DJ, Thompson M, Ritterson R, Loshbaugh AL, Pellegrino J, Krivacic C, Pache RA, Barlow KA, Ollikainen N, Jeon D, Kelly MJS, Fraser JS, Kortemme T.
Glasgow AA, et al. Among authors: krivacic c.
Science. 2019 Nov 22;366(6468):1024-1028. doi: 10.1126/science.aax8780.
Science. 2019.
PMID: 31754004
Free PMC article.
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Accurate positioning of functional residues with robotics-inspired computational protein design.
Krivacic C, Kundert K, Pan X, Pache RA, Liu L, Conchúir SO, Jeliazkov JR, Gray JJ, Thompson MC, Fraser JS, Kortemme T.
Krivacic C, et al.
Proc Natl Acad Sci U S A. 2022 Mar 15;119(11):e2115480119. doi: 10.1073/pnas.2115480119. Epub 2022 Mar 7.
Proc Natl Acad Sci U S A. 2022.
PMID: 35254891
Free PMC article.
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Distal structural elements coordinate a conserved base flipping network.
Matje DM, Krivacic CT, Dahlquist FW, Reich NO.
Matje DM, et al. Among authors: krivacic ct.
Biochemistry. 2013 Mar 12;52(10):1669-76. doi: 10.1021/bi301284f. Epub 2013 Feb 27.
Biochemistry. 2013.
PMID: 23409802
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