Takeuchi K - Search Results

1

Global Assessment of Substituents on the Basis of Analogue Series.

Takeuchi K, Kunimoto R, Bajorath J. Takeuchi K, et al. J Med Chem. 2020 Dec 10;63(23):15013-15020. doi: 10.1021/acs.jmedchem.0c01607. Epub 2020 Nov 30. J Med Chem. 2020. PMID: 33253557

2

R-group replacement database for medicinal chemistry.

Takeuchi K, Kunimoto R, Bajorath J. Takeuchi K, et al. Future Sci OA. 2021 Jun 30;7(8):FSO742. doi: 10.2144/fsoa-2021-0062. eCollection 2021 Sep. Future Sci OA. 2021. PMID: 34295541 Free PMC article.

3

Systematic mapping of R-group space enables the generation of an R-group replacement system for medicinal chemistry.

Takeuchi K, Kunimoto R, Bajorath J. Takeuchi K, et al. Eur J Med Chem. 2021 Dec 5;225:113771. doi: 10.1016/j.ejmech.2021.113771. Epub 2021 Aug 12. Eur J Med Chem. 2021. PMID: 34403977

4

Searchable database of frequent R-groups in medicinal chemistry and their preferred replacements.

Takeuchi K, Kunimoto R, Bajorath J. Takeuchi K, et al. Data Brief. 2021 Oct 8;39:107456. doi: 10.1016/j.dib.2021.107456. eCollection 2021 Dec. Data Brief. 2021. PMID: 34692956 Free PMC article.

5

Introducing a Chemically Intuitive Core-Substituent Fingerprint Designed to Explore Structural Requirements for Effective Similarity Searching and Machine Learning.

Janela T, Takeuchi K, Bajorath J. Janela T, et al. Among authors: takeuchi k. Molecules. 2022 Apr 4;27(7):2331. doi: 10.3390/molecules27072331. Molecules. 2022. PMID: 35408730 Free PMC article.

6

Predicting Potent Compounds Using a Conditional Variational Autoencoder Based upon a New Structure-Potency Fingerprint.

Janela T, Takeuchi K, Bajorath J. Janela T, et al. Among authors: takeuchi k. Biomolecules. 2023 Feb 18;13(2):393. doi: 10.3390/biom13020393. Biomolecules. 2023. PMID: 36830761 Free PMC article.

7

High-Entropy Spinel Oxide Ferrites for Battery Applications.

Nam KH, Wang Z, Luo J, Huang C, Millares MF, Pace A, Wang L, King ST, Ma L, Ehrlich S, Bai J, Takeuchi ES, Marschilok AC, Yan S, Takeuchi KJ, Doeff MM. Nam KH, et al. Among authors: takeuchi kj. Chem Mater. 2024 Apr 30;36(9):4481-4494. doi: 10.1021/acs.chemmater.4c00085. eCollection 2024 May 14. Chem Mater. 2024. PMID: 38764752 Free PMC article.

8

A high-resolution structural characterization and physicochemical study of how a peptoid binds to an oncoprotein MDM2.

Yokomine M, Morimoto J, Fukuda Y, Ueda T, Takeuchi K, Umezawa K, Ago H, Matsuura H, Ueno G, Senoo A, Nagatoishi S, Tsumoto K, Sando S. Yokomine M, et al. Among authors: takeuchi k. Chem Sci. 2024 Apr 19;15(19):7051-7060. doi: 10.1039/d4sc01540a. eCollection 2024 May 15. Chem Sci. 2024. PMID: 38756815 Free PMC article.

9

Early gastric cancer with RhoGAP fusion is linked to frequent nodal metastasis and a part of microtubular-mucocellular histology.

Noda H, Sakata S, Baba S, Togashi Y, Nakano K, Hirasawa T, Nakayama I, Hata C, Takamatsu M, Sugawara E, Yamamoto N, Fujisaki J, Nunobe S, Iwakiri K, Takeuchi K, Kawachi H. Noda H, et al. Among authors: takeuchi k. Gastric Cancer. 2024 May 16. doi: 10.1007/s10120-024-01507-4. Online ahead of print. Gastric Cancer. 2024. PMID: 38755445

10

Isolation and Structure Elucidation of JBIR-157, a Skeletally Novel Aromatic Polyketide Produced by the Heterologous Expression of a Cryptic Gene Cluster.

Nishimura T, Kudo K, Izumikawa M, Kozone I, Hashimoto J, Kagaya N, Suenaga H, Takeuchi K, Shin-Ya K. Nishimura T, et al. Among authors: takeuchi k. Chem Pharm Bull (Tokyo). 2024;72(5):475-479. doi: 10.1248/cpb.c24-00144. Chem Pharm Bull (Tokyo). 2024. PMID: 38749722 Free article.

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