Ligand name: 11-bromo-5,6,7,8-tetrahydropyrimido[4',5':3,4]cyclohepta[1,2-b]indol-2-amine
PDB ligand accession: T28
DrugBank: n/a
PubChem: 58221397
ChEMBL: CHEMBL2334583
InChI Key: MEOWHQIIZUZBTO-UHFFFAOYSA-N
SMILES: c1cc2c(cc1Br)c-3c([nH]2)CCCc4c3nc(nc4)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Indoles and derivatives
      • Subclass: Indoles

List of PDB structures and/or AlphaFold models with target protein Q99558

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4IDT	Download	Experimental	e4idtA2 e4idtB1	Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp	LigPlot