Cdk2 inhibitor IV

Ligand id: 5949

Name: Cdk2 inhibitor IV

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 96.03
Molecular weight 422.24
XLogP 4.57
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Large-scale screening data

EMD Millipore KinaseProfilerTM screen/Reaction Biology Kinase HotspotSM screen
A screen profiling 158 kinase inhibitors (Calbiochem Protein Kinase Inhibitor Library I and II, catalogue numbers 539744 and 539745) for their inhibitory activity at 1µM and 10µM against 234 human recombinant kinases using the EMD Millipore KinaseProfilerTM service.

A screen profiling the inhibitory activity of 178 commercially available kinase inhibitors at 0.5µM against a panel of 300 recombinant protein kinases using the Reaction Biology Corporation Kinase HotspotSM platform.

http://www.millipore.com/techpublications/tech1/pf3036
http://www.reactionbiology.com/webapps/main/pages/kinase.aspx


Reference: 1,3

Key to terms and symbols Click column headers to sort
Target Name in screen Sp. Type Action % Activity remaining at 0.5µM % Activity remaining at 1µM % Activity remaining at 10µM
leucine rich repeat kinase 2 nd/LRRK2 Hs Inhibitor Inhibition 2.2
aurora kinase A Aurora-A/Aurora A Hs Inhibitor Inhibition 3.0 1.0 5.0
NUAK family kinase 1 ARK5/ARK5(NUAK1) Hs Inhibitor Inhibition 3.7 2.0 4.0
mitogen-activated protein kinase kinase kinase 9 MLK1/MLK19MAP3K90 Hs Inhibitor Inhibition 3.8 2.0 1.0
Janus kinase 2 JAK2/JAK2 Hs Inhibitor Inhibition 4.2 3.0 -1.0
tyrosine kinase 2 nd/TYK2 Hs Inhibitor Inhibition 5.0
mitogen-activated protein kinase kinase kinase 11 nd/MLK3(MAP3K11) Hs Inhibitor Inhibition 5.6
colony stimulating factor 1 receptor Fms/FMS Hs Inhibitor Inhibition 5.7 1.0 2.0
Janus kinase 3 JAK3/JAK3 Hs Inhibitor Inhibition 6.4 7.0 1.0
ret proto-oncogene Ret/RET Hs Inhibitor Inhibition 7.6 3.0 0.0
Displaying the top 10 targets  View all targets in screen »