PDB ligand accession: JAN
DrugBank: DB04960
PubChem:
ChEMBL:
InChI Key: PLHJCIYEEKOWNM-HHHXNRCGSA-N
SMILES: CN1C=NC=C1[C@@](N)(C1=CC=C(Cl)C=C1)C1=CC2=C(C=C1)N(C)C(=O)C=C2C1=CC(Cl)=CC=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
TYR | 300 | Phosphorylation | PyMOL_Chai1 |