Ligand name: methyl (3S)-3-{2-[(1,3-benzodioxol-5-ylmethyl)amino]-2-oxoethyl}-4-[2-(1H-imidazol-1-yl)pyrimidin-4-yl]piperazine-1-carboxylate
PDB ligand accession: 1PM
DrugBank: n/a
PubChem: 16116169
ChEMBL: CHEMBL385324
InChI Key: NVYMEDQKBQMAKF-KRWDZBQOSA-N
SMILES: COC(=O)N1CCN(C(C1)CC(=O)NCc2ccc3c(c2)OCO3)c4ccnc(n4)n5ccnc5
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazinanes
      • Subclass: Piperazines

List of PDB structures and/or AlphaFold models with target protein P29477

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1DD7	Download	Experimental	e1dd7A2	Nitric oxide (NO) synthase oxygenase domain	LigPlot