PDB ligand accession: 199
DrugBank: DB06876
PubChem:
ChEMBL: n/a
InChI Key: YJWJKKXGAPWLGT-UHFFFAOYSA-N
SMILES: CN1CCN(CC1)C1=CC=C(C=C1)C1=CC2=C(NC=C2NC(=O)C2=CN=CC=C2)N=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
LYS | 145 | Ubiquitination |