compound 51 [Mallinger et al., 2016]

Ligand id: 9170

Name: compound 51 [Mallinger et al., 2016]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 99.16
Molecular weight 414.18
XLogP 2.26
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

No information available.
Mechanism Of Action and Pharmacodynamic Effects
CDK8, and its closely related isoform CDK19, are oncogenic transcription-regulating kinases. CDK8 depletion does not inhibit the growth of normal cells. CDK8 is a regulator of several transcriptional programs involved in carcinogenesis (such as the Wnt/β-catenin and TGFβ signaling pathways). CDK8 is reported to be oncogenic in melanoma [2] and colon cancers [1]. CDK8 is upregulated and amplified in a subset of human colon tumours and is required for colon cancer proliferation in vitro. Inhibitors of CDK8/19 are therefore being developed for use in oncology.