Ligand name: 4-[(4-{[4-(4-cyano-2,6-dimethylphenoxy)thieno[3,2-d]pyrimidin-2-yl]amino}piperidin-1-yl)methyl]benzene-1-sulfonamide
PDB ligand accession: K5A
DrugBank: n/a
PubChem: 129907910
ChEMBL: CHEMBL3929927
InChI Key: ZTRXHQCTETXYCC-UHFFFAOYSA-N
SMILES: Cc1cc(cc(c1Oc2c3c(ccs3)nc(n2)NC4CCN(CC4)Cc5ccc(cc5)S(=O)(=O)N)C)C#N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Piperidines
      • Subclass: Benzylpiperidines

List of PDB structures and/or AlphaFold models with target protein P03366

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6C0K	Download	Experimental	e6c0kA1 e6c0kA3 e6c0kB3	Alpha-beta plaits Ribonuclease H-like Alpha-beta plaits	LigPlot
6C0L	Download	Experimental	e6c0lA1 e6c0lA2 e6c0lB3	Ribonuclease H-like Alpha-beta plaits Alpha-beta plaits	LigPlot
6C0J	Download	Experimental	e6c0jA2 e6c0jA3 e6c0jB2	Alpha-beta plaits Ribonuclease H-like Alpha-beta plaits	LigPlot
6CGF	Download	Experimental	e6cgfA1 e6cgfA4 e6cgfB1	Ribonuclease H-like Alpha-beta plaits Alpha-beta plaits	LigPlot