Ligand name: Fedratinib
PDB ligand accession: 2TA
DrugBank: DB12500
PubChem: 16722836
ChEMBL: CHEMBL1287853
InChI Key: JOOXLOJCABQBSG-UHFFFAOYSA-N
SMILES: CC1=CN=C(NC2=CC=C(OCCN3CCCC3)C=C2)N=C1NC1=CC=CC(=C1)S(=O)(=O)NC(C)(C)C
Drug action: n/a

List of small molecule binding-associated PTMs for O60674

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
TYR 931 Phosphorylation PyMOL_Chai1
TYR 934 Phosphorylation PyMOL_RFAA PyMOL_Chai1
SER 936 Phosphorylation PyMOL_Chai1
TYR 940 Phosphorylation PyMOL_Chai1