Cdk1/5 inhibitor   Click here for help

GtoPdb Ligand ID: 5947

Synonyms: quinoxaline1
Compound class: Synthetic organic
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 0
Topological polar surface area 80.48
Molecular weight 185.07
XLogP 1.25
No. Lipinski's rules broken 0
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Canonical SMILES Nc1[nH]nc2c1nc1ccccc1n2
Isomeric SMILES Nc1[nH]nc2c1nc1ccccc1n2
InChI InChI=1S/C9H7N5/c10-8-7-9(14-13-8)12-6-4-2-1-3-5(6)11-7/h1-4H,(H3,10,12,13,14)

Large-scale screening data

EMD Millipore KinaseProfilerTM screen/Reaction Biology Kinase HotspotSM screen Click here for help
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.

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
Protein kinase G (PKG) 2 nd/PKG2(PRKG2) Hs Inhibitor Inhibition 66.7
Janus kinase 3 JAK3/JAK3 Hs Inhibitor Inhibition 68.0 108.0 85.0
protein kinase C alpha PKCα/PKCa Hs Inhibitor Inhibition 71.0 101.0 105.0
fms related receptor tyrosine kinase 3 Flt3/FLT3 Hs Inhibitor Inhibition 75.9 70.0 45.0
mitogen-activated protein kinase kinase kinase kinase 4 nd/HGK(MAP4K4) Hs Inhibitor Inhibition 76.2
ribosomal protein S6 kinase A4 MSK2/MSK2(RPS6KA4) Hs Inhibitor Inhibition 79.0 102.0 81.0
cyclin dependent kinase 1 CDK1-cyclin B/CDK1-cyclin B Hs Inhibitor Inhibition 79.6 96.0 59.0
receptor interacting serine/threonine kinase 2 RIPK2/RIPK2 Hs Inhibitor Inhibition 81.1 94.0 82.0
mitogen-activated protein kinase kinase kinase 8 nd/COT1(MAP3K8) Hs Inhibitor Inhibition 81.3
cyclin dependent kinase 9 CDK9-cyclin T1/CDK9-cyclin T1 Hs Inhibitor Inhibition 81.6 59.0 36.0
Displaying the top 10 targets  View all targets in screen »