PDB ligand accession: 68P
DrugBank: DB01175
PubChem:
ChEMBL:
InChI Key: WSEQXVZVJXJVFP-FQEVSTJZSA-N
SMILES: CN(C)CCC[C@]1(OCC2=C1C=CC(=C2)C#N)C1=CC=C(F)C=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
SER | 91 | Phosphorylation | PyMOL_Chai1 | ||
SER | 559 | Phosphorylation | PyMOL_Chai1 |