Ligand name: 3-[5-(1H-IMIDAZOL-1-YL)-7-METHYL-1H-BENZIMIDAZOL-2-YL]-4-[(PYRIDIN-2-YLMETHYL)AMINO]PYRIDIN-2(1H)-ONE
PDB ligand accession: BMI
DrugBank: DB07474
PubChem: 135530418
ChEMBL: CHEMBL397666
InChI Key: GLTRPHMPCVLOJS-UHFFFAOYSA-N
SMILES: CC1=CC(=CC2=C1N=C(N2)C1=C(NCC2=NC=CC=C2)C=CNC1=O)N1C=CN=C1
Drug action: n/a

List of small molecule binding-associated PTMs for P08069

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
LYS 1088 Acetylation PyMOL_RFAA
SER 1009 Phosphorylation PyMOL_RFAA
TYR 1014 Phosphorylation PyMOL_RFAA PyMOL_Chai1
TYR 1161 Phosphorylation PyMOL_RFAA PyMOL_Chai1
THR 1157 Phosphorylation PyMOL_RFAA
LYS 1033 Ubiquitination