PDB ligand accession: 4MK
DrugBank: DB09063
PubChem:
ChEMBL:
InChI Key: VERWOWGGCGHDQE-UHFFFAOYSA-N
SMILES: CC(C)OC1=C(NC2=NC=C(Cl)C(N2)=NC2=CC=CC=C2S(=O)(=O)C(C)C)C=C(C)C(=C1)C1CCNCC1
Drug action: n/a
| Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
|---|---|---|---|---|---|
| TYR | 1131 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
| SER | 1206 | Phosphorylation | PyMOL_RFAA |