Ligand name: (S)-N-(5-chloro-3-((4-(cyclopentanecarbonyl)-3-methylpiperazin-1-yl)methyl)-2-methylphenyl)-2-methylpyrimidine-5-carboxamide
PDB ligand accession: 98E
DrugBank: n/a
PubChem: 76072599
ChEMBL: CHEMBL5205088
InChI Key: HAXBJJXPLDXDIL-INIZCTEOSA-N
SMILES: Cc1c(cc(cc1NC(=O)c2cnc(nc2)C)Cl)CN3CCN(C(C3)C)C(=O)C4CCCC4
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Anilides

List of PDB structures and/or AlphaFold models with target protein P51449

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5NTP	Download	Experimental	e5ntpA1	Nuclear receptor ligand-binding domain	LigPlot