PDB ligand accession: 09L
DrugBank: DB09074
PubChem:
ChEMBL:
InChI Key: FDLYAMZZIXQODN-UHFFFAOYSA-N
SMILES: FC1=CC=C(CC2=NNC(=O)C3=CC=CC=C23)C=C1C(=O)N1CCN(CC1)C(=O)C1CC1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
ARG | 878 | Methylation | PyMOL_RFAA | ||
SER | 864 | Phosphorylation | PyMOL_Chai1 | ||
SER | 874 | Phosphorylation | PyMOL_Chai1 | ||
MET | 900 | Sulfoxidation | PyMOL_Chai1 | ||
THR | 867 | Phosphorylation | PyMOL_Chai1 |