PDB ligand accession: 07J
DrugBank: DB11886
PubChem:
ChEMBL:
InChI Key: QADPYRIHXKWUSV-UHFFFAOYSA-N
SMILES: CCN1CCN(CC1)C1=CC=C(NC2=CC(=NC=N2)N(C)C(=O)NC2=C(Cl)C(OC)=CC(OC)=C2Cl)C=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
SER | 588 | Phosphorylation | PyMOL_Chai1 |