Ligand name: 1-(3,4-diazatricyclo[9.4.0.0^{2,7}]pentadeca-1(11),2(7),3,5,12,14-hexaen-5-yl)-~{N}3-[(7~{S})-7-pyrrolidin-1-yl-6,7,8,9-tetrahydro-5~{H}-benzo[7]annulen-3-yl]-1,2,4-triazole-3,5-diamine
PDB ligand accession: Q8U
DrugBank: DB12411
PubChem: 46215462
ChEMBL: CHEMBL3809489
InChI Key: KXMZDGSRSGHMMK-VWLOTQADSA-N
SMILES: c1ccc-2c(c1)CCCc3c2nnc(c3)n4c(nc(n4)Nc5ccc6c(c5)CCC(CC6)N7CCCC7)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic nitrogen compounds
    • Class: Organonitrogen compounds
      • Subclass: Amines

List of PDB structures and/or AlphaFold models with target protein O60674

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
8BA4	Download	Experimental	e8ba4A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
8BA3	Download	Experimental	e8ba3A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot