Ligand name: (3~{R})-4-[2-[4-[1-(3-methoxy-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidin-4-yl]phenoxy]ethyl]-1,3-dimethyl-piperazin-2-one
PDB ligand accession: XNH
DrugBank: DB17018
PubChem: 118693659
ChEMBL: CHEMBL4078100
InChI Key: RSMYFSPOTCDHHJ-GOSISDBHSA-N
SMILES: CC1C(=O)N(CCN1CCOc2ccc(cc2)C3CCN(CC3)c4ccc5nnc(n5n4)OC)C
Drug action: inhibitor

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Piperidines
      • Subclass: Phenylpiperidines

List of PDB structures and/or AlphaFold models with target protein O60885

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5KHM	Download	Experimental	e5khmA1 e5khmB1	Bromodomain-like Bromodomain-like	LigPlot