Ligand name: (3R,4R)-1-{6-[3-(METHYLSULFONYL)PHENYL]PYRIMIDIN-4-YL}-4-(2,4,5-TRIFLUOROPHENYL)PIPERIDIN-3-AMINE
PDB ligand accession: MA9
DrugBank: DB08164
PubChem: 16058650
ChEMBL: CHEMBL1234200
InChI Key: GOBIXGZJSMAOFV-QRWLVFNGSA-N
SMILES: CS(=O)(=O)c1cccc(c1)c2cc(ncn2)N3CCC(C(C3)N)c4cc(c(cc4F)F)F
Drug action: n/a

ClassyFire chemical classification:

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

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P27487

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2OQV	Download	Experimental	e2oqvA2 e2oqvA1	alpha/beta-Hydrolases beta-propeller-like	LigPlot