Working Paper
Authors
- Jumpei Maki Kyoto University ,
- Asami Oshimura Kyoto University ,
- Chihiro Tsukano
Kyoto University ,
- Ryo Yanagita Kagawa University ,
- Yutaka Saito Waseda University & National Institute of Advanced Industrial Science and Technology ,
- Yasubumi Sakakibara Keio University ,
- Kazuhiro Irie Kyoto University
Abstract
We have designed and synthesized a new PKC ligand with a novel skeleton based on alotaketals through in silico screening, docking analysis, and molecular dynamics simulation. We found that the new ligand has a higher affinity for PKCα-C1A than for PKCδ-C1B. This compound is expected to serve as the basis for developing PKC ligands with isozyme selectivity.
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