PKR inhibitor, negative control   Click here for help

GtoPdb Ligand ID: 6027

Synonyms: RNA-dependent protein kinase inhibitor, negative control
Compound class: Synthetic organic
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 1
Topological polar surface area 49.33
Molecular weight 338.96
XLogP 4.56
No. Lipinski's rules broken 0
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Canonical SMILES Clc1ccc2c(c1)C(=Cc1cc(Cl)c(c(c1)Cl)O)C(=O)N2
Isomeric SMILES Clc1ccc2c(c1)/C(=C/c1cc(Cl)c(c(c1)Cl)O)/C(=O)N2
InChI InChI=1S/C15H8Cl3NO2/c16-8-1-2-13-9(6-8)10(15(21)19-13)3-7-4-11(17)14(20)12(18)5-7/h1-6,20H,(H,19,21)/b10-3-

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: 1-2

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 kinase kinase kinase 4 nd/HGK(MAP4K4) Hs Inhibitor Inhibition 4.5
Raf-1 proto-oncogene, serine/threonine kinase c-RAF/RAF1 Hs Inhibitor Inhibition 6.9 2.0 -2.0
histone H3 associated protein kinase Haspin/Haspin Hs Inhibitor Inhibition 8.7 12.0 1.0
aurora kinase B Aurora-B/Aurora B Hs Inhibitor Inhibition 9.2 51.0 2.0
B-Raf proto-oncogene, serine/threonine kinase nd/BRAF Hs Inhibitor Inhibition 10.2
leucine rich repeat kinase 2 nd/LRRK2 Hs Inhibitor Inhibition 11.0
Pim-3 proto-oncogene, serine/threonine kinase Pim-3/PIM3 Hs Inhibitor Inhibition 14.5 77.0 30.0
myosin IIIB nd/MYO3b Hs Inhibitor Inhibition 17.4
Pim-1 proto-oncogene, serine/threonine kinase Pim-1/PIM1 Hs Inhibitor Inhibition 19.4 24.0 5.0
misshapen like kinase 1 MINK/MINK(MINK1) Hs Inhibitor Inhibition 22.4 35.0 35.0
Displaying the top 10 targets  View all targets in screen »