Ligand name: 3-ISOBUTYL-1-METHYLXANTHINE
PDB ligand accession: IBM
DrugBank: DB07954
PubChem: 3758
ChEMBL: CHEMBL275084
InChI Key: APIXJSLKIYYUKG-UHFFFAOYSA-N
SMILES: CC(C)CN1c2c(nc[nH]2)C(=O)N(C1=O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Imidazopyrimidines
      • Subclass: Purines and purine derivatives

List of PDB structures and/or AlphaFold models with target protein Q13370

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1SOJ	Download	Experimental	e1sojA1 e1sojB1 e1sojC1 e1sojD1 e1sojE1 e1sojF1 e1sojG1 e1sojH1 e1sojI1 e1sojJ1 e1sojK1 e1sojL1	PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like PDEase-like	LigPlot