Ligand name: 5-(2-morpholin-4-yl-6-pyrrolidin-1-yl-pyrimidin-4-yl)-4-(trifluoromethyl)pyridin-2-amine
PDB ligand accession: 918
DrugBank: n/a
PubChem: 124201645
ChEMBL: n/a
InChI Key: LAOJHMTYUJTJTR-UHFFFAOYSA-N
SMILES: c1c(c(cnc1N)c2cc(nc(n2)N3CCOCC3)N4CCCC4)C(F)(F)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazines
      • Subclass: Pyrimidines and pyrimidine derivatives

List of PDB structures and/or AlphaFold models with target protein Q6B856

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5M8G	Download	Experimental	e5m8gA1 e5m8gA2 e5m8gB1 e5m8gB2 e5m8gC2 e5m8gD1 e5m8gD2	Bacillus chorismate mutase-like Rossmann-like Bacillus chorismate mutase-like Rossmann-like Rossmann-like Bacillus chorismate mutase-like Rossmann-like	LigPlot