MEK inhibitor II   Click here for help

GtoPdb Ligand ID: 6007

Synonyms: NSC-686549 | NSC686549
Compound class: Synthetic organic
Click here for help
2D Structure
Click here for help
Click here for structure editor
Physico-chemical Properties
Click here for help
Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 1
Topological polar surface area 71.52
Molecular weight 289.01
XLogP 1.06
No. Lipinski's rules broken 0
Click here for help
Canonical SMILES O=C1CCC(=O)N1C1=C(Cl)C(=O)c2c(C1=O)cccc2
Isomeric SMILES O=C1CCC(=O)N1C1=C(Cl)C(=O)c2c(C1=O)cccc2
InChI InChI=1S/C14H8ClNO4/c15-11-12(16-9(17)5-6-10(16)18)14(20)8-4-2-1-3-7(8)13(11)19/h1-4H,5-6H2

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
mitogen-activated protein kinase 1 MAPK2/ERK2(MAPK1) Hs Inhibitor Inhibition 73.6 110.0 102.0
MAPK activated protein kinase 5 PRAK/MAPKAPK5(PRAK) Hs Inhibitor Inhibition 73.6 92.0 98.0
mitogen-activated protein kinase kinase 1 MEK1/MEK1 Hs Inhibitor Inhibition 76.5 107.0 67.0
microtubule affinity regulating kinase 2 PAR-1Bα/MARK2(PAR-1Ba) Hs Inhibitor Inhibition 79.4 98.0 96.0
C-terminal Src kinase CSK/CSK Hs Inhibitor Inhibition 79.5 103.0 96.0
TAO kinase 1 TAO1/TAOK1 Hs Inhibitor Inhibition 83.1 89.0 94.0
MAPK interacting serine/threonine kinase 2 Mnk2/MNK2 Hs Inhibitor Inhibition 84.5 102.0 94.0
KIT proto-oncogene, receptor tyrosine kinase cKit/c-Kit Hs Inhibitor Inhibition 84.7 101.0 98.0
receptor interacting serine/threonine kinase 2 RIPK2/RIPK2 Hs Inhibitor Inhibition 84.8 92.0 95.0
calcium/calmodulin dependent protein kinase kinase 2 nd/CAMKK2 Hs Inhibitor Inhibition 86.1
Displaying the top 10 targets  View all targets in screen »