Ligand name: 6-[2-(3,3-dimethylbut-1-yn-1-yl)phenyl]quinolin-2-amine
PDB ligand accession: RTH
DrugBank: n/a
PubChem: 53346493
ChEMBL: CHEMBL1821808
InChI Key: IFUYBWIZKMAADM-UHFFFAOYSA-N
SMILES: CC(C)(C)C#Cc1ccccc1c2ccc3c(c2)ccc(n3)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Quinolines and derivatives
      • Subclass: Phenylquinolines

List of PDB structures and/or AlphaFold models with target protein P56817

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3RTH	Download	Experimental	e3rthA2 e3rthA3	cradle loop barrel cradle loop barrel	LigPlot