Ligand name: 2-hydroxy-1-(4-(isoquinolin-5-yl)piperazin-1-yl)-2-methyl-3-(3-methyl-4-phenyl-1H-pyrazol-1-yl)propan-1-one
PDB ligand accession: U7H
DrugBank: n/a
PubChem: 155817693
ChEMBL: n/a
InChI Key: NIAOQHXCKBVCFC-MHZLTWQESA-N
SMILES: Cc1c(cn(n1)CC(C)(C(=O)N2CCN(CC2)c3cccc4c3ccnc4)O)c5ccccc5
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 P40261

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7NBJ	Download	Experimental	e7nbjA1 e7nbjB1 e7nbjC1 e7nbjD1	Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot