Ligand name: 2-fluoro-5-{5-[(2E,4aR,7aR)-2-imino-3-methyl-4-oxo-6-phenyloctahydro-7aH-pyrrolo[3,4-d]pyrimidin-7a-yl]thiophen-2-yl}benzonitrile
PDB ligand accession: 10W
DrugBank: n/a
PubChem: 60210991
ChEMBL: CHEMBL2178148
InChI Key: DWVJKKOFIHHAKC-UUOWRZLLSA-N
SMILES: CN1C(=O)C2CN(CC2(NC1=N)c3ccc(s3)c4ccc(c(c4)C#N)F)c5ccccc5
Drug action: n/a

ClassyFire chemical classification:

List of PDB structures and/or AlphaFold models with target protein P56817

PDB/AF Accession PyMOL script Experimental / Predicted Interacting ECOD domains ECOD X-group name LigPlot
4H3J Download Experimental e4h3jA2
e4h3jA3
e4h3jB2
e4h3jB3
cradle loop barrel
cradle loop barrel
cradle loop barrel
cradle loop barrel
LigPlot