Ligand name: JNJ-27390467
PDB ligand accession: 2FF
DrugBank: DB06962
InChI Key: YKTUSHSSKIWDRY-UHFFFAOYSA-N
SMILES: c1ccc(cc1)C#Cc2ccc(o2)C(=O)N3CCC4(CC3)COc5c4cc(cc5)CN
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzofurans
      • Subclass: None

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P20231

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name
P20231	Download	Predicted	P20231_F1_nD1	cradle loop barrel
1A0L		Predicted	e1a0lC1 e1a0lB1 e1a0lD1 e1a0lA1
2BM2		Predicted	e2bm2D1 e2bm2C1 e2bm2A1 e2bm2B1
2FPZ		Predicted	e2fpzC1 e2fpzD1 e2fpzA1 e2fpzB1
2FS8		Predicted	e2fs8A1 e2fs8D1 e2fs8B1 e2fs8C1
2FS9		Predicted	e2fs9B1 e2fs9A1 e2fs9D1 e2fs9C1
2FWW		Predicted	e2fwwC1 e2fwwD1 e2fwwA1 e2fwwB1
2FXR		Predicted	e2fxrB1 e2fxrC1 e2fxrA1 e2fxrD1
2GDD		Predicted	e2gddA1 e2gddD1 e2gddC1 e2gddB1
2ZA5		Predicted	e2za5B1 e2za5D1 e2za5A1 e2za5C1
3V7T		Predicted	e3v7tC1 e3v7tB1 e3v7tD1 e3v7tA2