axitinib

Ligand id: 5659

Name: axitinib

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 6
Topological polar surface area 95.97
Molecular weight 386.12
XLogP 5.77
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Large-scale screening data

DiscoveRx KINOMEscan® screen
A screen of 72 inhibitors against 456 human kinases. Quantitative data were derived using DiscoveRx KINOMEscan® platform.
http://www.discoverx.com/services/drug-discovery-development-services/kinase-profiling/kinomescan
Reference: 1,4

Key to terms and symbols Click column headers to sort
Target Name in screen Sp. Type Action Affinity Units
KIT proto-oncogene receptor tyrosine kinase KIT(V559D) Hs Inhibitor Inhibition 9.3 pKd
platelet derived growth factor receptor alpha PDGFRA Hs Inhibitor Inhibition 9.3 pKd
platelet derived growth factor receptor beta PDGFRB Hs Inhibitor Inhibition 9.2 pKd
aurora kinase C AURKC Hs Inhibitor Inhibition 8.9 pKd
KIT proto-oncogene receptor tyrosine kinase KIT(V559D,T670I) Hs Inhibitor Inhibition 8.9 pKd
ABL proto-oncogene 1, non-receptor tyrosine kinase ABL1(T315I)-phosphorylated Hs Inhibitor Inhibition 8.8 pKd
KIT proto-oncogene receptor tyrosine kinase KIT(L576P) Hs Inhibitor Inhibition 8.8 pKd
KIT proto-oncogene receptor tyrosine kinase KIT Hs Inhibitor Inhibition 8.5 pKd
KIT proto-oncogene receptor tyrosine kinase KIT(V559D,V654A) Hs Inhibitor Inhibition 8.5 pKd
ABL proto-oncogene 1, non-receptor tyrosine kinase ABL1(T315I)-nonphosphorylated Hs Inhibitor Inhibition 8.4 pKd
Displaying the top 10 targets  View all targets in screen »