Ligand name: 4-({4-[(4-{4-[(E)-2-cyanoethenyl]-2,6-dimethylphenoxy}thieno[3,2-d]pyrimidin-2-yl)amino]piperidin-1-yl}methyl)benzene-1-sulfonamide
PDB ligand accession: K5C
DrugBank: n/a
PubChem: 129909338
ChEMBL: CHEMBL4094163
InChI Key: GVCHBMCBPBRORW-ONEGZZNKSA-N
SMILES: Cc1cc(cc(c1Oc2c3c(ccs3)nc(n2)NC4CCN(CC4)Cc5ccc(cc5)S(=O)(=O)N)C)C=CC#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
6C0O	Download	Experimental	e6c0oA2 e6c0oA4 e6c0oB3	Ribonuclease H-like Alpha-beta plaits Alpha-beta plaits	LigPlot
6DUH	Download	Experimental	e6duhA3 e6duhA4 e6duhB2	Alpha-beta plaits Ribonuclease H-like Alpha-beta plaits	LigPlot
6C0R	Download	Experimental	e6c0rA3 e6c0rA4 e6c0rB3	Alpha-beta plaits Ribonuclease H-like Alpha-beta plaits	LigPlot
6C0P	Download	Experimental	e6c0pA1 e6c0pA4 e6c0pB3	Ribonuclease H-like Alpha-beta plaits Alpha-beta plaits	LigPlot
6C0N	Download	Experimental	e6c0nA2 e6c0nA3 e6c0nB3	Ribonuclease H-like Alpha-beta plaits Alpha-beta plaits	LigPlot
6DUG	Download	Experimental	e6dugA1 e6dugA3 e6dugB3	Ribonuclease H-like Alpha-beta plaits Alpha-beta plaits	LigPlot
6DUF	Download	Experimental	e6dufA1 e6dufA3 e6dufB3	Ribonuclease H-like Alpha-beta plaits Alpha-beta plaits	LigPlot