Ligand name: (1~{S},2~{R},3~{S},5~{R})-3-[2-(2-azanyl-3-bromanyl-quinolin-7-yl)ethyl]-5-(4-azanylpyrrolo[2,3-d]pyrimidin-7-yl)cyclop entane-1,2-diol
PDB ligand accession: K8N
DrugBank: n/a
PubChem: 126637809
ChEMBL: CHEMBL4249337
InChI Key: DBSMLQTUDJVICQ-CJODITQLSA-N
SMILES: c1cc2cc(c(nc2cc1CCC3CC(C(C3O)O)n4ccc5c4ncnc5N)N)Br
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Quinolines and derivatives
      • Subclass: Aminoquinolines and derivatives

List of PDB structures and/or AlphaFold models with target protein O14744

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6RLQ	Download	Experimental	e6rlqA2 e6rlqA3	Arginine methyltransferase oligomerization subdomain Rossmann-like	LigPlot