PDB ligand accession: 89I
DrugBank: DB07280
PubChem:
ChEMBL:
InChI Key: AINVOEOJEKKMKB-UHFFFAOYSA-N
SMILES: CN(C)C1=CC=C(C=C1)C1=C(N=CN=C1N)C#CC1=CC=C(N=C1)N1CCOCC1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
THR | 83 | Phosphorylation | PyMOL_RFAA | ||
SER | 86 | Phosphorylation | PyMOL_RFAA | ||
TYR | 183 | Phosphorylation | PyMOL_Chai1 | ||
SER | 82 | Phosphorylation | PyMOL_RFAA |