Ligand name: ~{N}-(5-bromanylpyridin-2-yl)-3-(4-oxidanylidenequinazolin-3-yl)propanamide
PDB ligand accession: RP9
DrugBank: n/a
PubChem: 16426130
ChEMBL: CHEMBL4558806
InChI Key: FGODKUDXJWXULG-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)C(=O)N(C=N2)CCC(=O)Nc3ccc(cn3)Br
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazanaphthalenes
      • Subclass: Benzodiazines

List of PDB structures and/or AlphaFold models with target protein Q16531

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
8BUD	Download	Experimental	e8budA2 e8budB1 e8budD3 e8budE1 e8budG2 e8budH1	beta-propeller-like Protein kinase/SAICAR synthase/ATP-grasp beta-propeller-like Protein kinase/SAICAR synthase/ATP-grasp beta-propeller-like Protein kinase/SAICAR synthase/ATP-grasp	LigPlot