Ligand name: (3S)-1-[2-(4-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}piperidine-3-carboxamide
PDB ligand accession: TIW
DrugBank: n/a
PubChem: 92895288
ChEMBL: CHEMBL5426484
InChI Key: VWUOWUZLQDJSCV-FQEVSTJZSA-N
SMILES: Cc1ccc(cc1)n2cc3c(n2)ncnc3N4CCCC(C4)C(=O)NCc5ccc(cc5)SC
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Azoles
      • Subclass: Pyrazoles

List of PDB structures and/or AlphaFold models with target protein P43490

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
8DSD	Download	Experimental	e8dsdA1 e8dsdB1	TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot