In Search of Novel CDK8 Inhibitors by Virtual Screening
Sign Up to like & getrecommendations! Published in 2017 at "Journal of chemical information and modeling"
DOI: 10.1021/acs.jcim.6b00711
Abstract: Aberrant activity of cyclin-dependent kinase (CDK) 8 is implicated in various cancers. While CDK8-targeting anticancer drugs are highly sought-after, no CDK8 inhibitor has yet reached clinical trials. Herein a large library of drug-like molecules was… read more here.
Keywords: virtual screening; cdk8 inhibitors; search novel; cdk8 ... See more keywords
Identification of PARP12 Inhibitors By Virtual Screening and Molecular Dynamics Simulations
Sign Up to like & getrecommendations! Published in 2022 at "Frontiers in Pharmacology"
DOI: 10.3389/fphar.2022.847499
Abstract: Poly [adenosine diphosphate (ADP)-ribose] polymerases (PARPs) are members of a family of 17 enzymes that performs several fundamental cellular processes. Aberrant activity (mutation) in PARP12 has been linked to various diseases including inflammation, cardiovascular disease,… read more here.
Keywords: inhibitors virtual; identification parp12; virtual screening; molecular dynamics ... See more keywords