Ligand name: 2-({2-[(3R)-3-aminopiperidin-1-yl]-5-bromo-6-oxopyrimidin-1(6H)-yl}methyl)benzonitrile
PDB ligand accession: RUM
DrugBank: n/a
PubChem: 11246214
ChEMBL: CHEMBL1235761
InChI Key: GGCILSXUAHLDMF-CQSZACIVSA-N
SMILES: c1ccc(c(c1)CN2C(=O)C(=CN=C2N3CCCC(C3)N)Br)C#N
Drug action: n/a

ClassyFire chemical classification:

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

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
3G0G	Download	Experimental	e3g0gA1 e3g0gA2 e3g0gB1 e3g0gB2 e3g0gC1 e3g0gC2 e3g0gD1 e3g0gD2	beta-propeller-like alpha/beta-Hydrolases beta-propeller-like alpha/beta-Hydrolases beta-propeller-like alpha/beta-Hydrolases beta-propeller-like alpha/beta-Hydrolases	LigPlot