openmolecules.org

 
Home » DataWarrior » Cheminformatics » LE, LLE & LELP
LE, LLE & LELP [message #1496] Mon, 07 February 2022 13:51
Christophe is currently offline  Christophe
Messages: 31
Registered: January 2022
Member
Hello everyone,

If I only have Kd data instead of IC50 for my compounds. Does it make any sense to calculate normalized Ligand efficiencies (LE, LLE and/or LELP) based on Kd rather than on a true activity ?
It happens (very/too often) that a low Kd does not correlate with high activity, but in my particular case, Kd can be easily measured contrary to IC50.
Many thanks
 
Read Message
Previous Topic: 3-D structures vs descriptors
Next Topic: Importing compounds with assay data from Pubchem into Datawarrior
Goto Forum:
  


Current Time: Fri Nov 22 06:29:38 CET 2024

Total time taken to generate the page: 0.04034 seconds