Ligand name: N,4-dimethyl-3-[(1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)amino]benzamide
PDB ligand accession: N4D
DrugBank: DB08242
PubChem: 23400214
ChEMBL: CHEMBL410668
InChI Key: OYTBZXSFNNAVKU-UHFFFAOYSA-N
SMILES: CNC(=O)C1=CC(NC2=C3C=NN(C3=NC=N2)C2=CC=CC=C2)=C(C)C=C1
Drug action: n/a

List of small molecule binding-associated PTMs for Q16539

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
LYS	53	Acetylation		PyMOL_RFAA
SER	28	Phosphorylation		PyMOL_RFAA
TYR	323	Phosphorylation			PyMOL_Chai1
SER	37	Phosphorylation		PyMOL_RFAA