Ligand name: 3-[3-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)quinoxalin-5-yl]phenol
PDB ligand accession: IHX
DrugBank: DB07969
PubChem: 25113181
ChEMBL: CHEMBL462712
InChI Key: QNCYYRHIUFGGJX-UHFFFAOYSA-N
SMILES: CN1CCN(CC1)C1=NC2=C(C=C(C=C2N=C1)C(F)(F)F)C1=CC(O)=CC=C1
Drug action: n/a

List of small molecule binding-associated PTMs for P08581

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
LYS 1110 Acetylation PyMOL_Chai1
TYR 1093 Phosphorylation PyMOL_Chai1
TYR 1230 Phosphorylation PyMOL_Chai1
LYS 1161 Ubiquitination
LYS 1232 Ubiquitination