Ligand name: (1R,2S,3S,4R)-4-hydroxy-2-methoxy-4-methyl-3-[(2R,3R)-2-methyl-3-(3-methylbut-2-en-1-yl)oxiran-2-yl]cyclohexyl (chloroacetyl)carbamate
PDB ligand accession: TN4
DrugBank: DB08633
PubChem: 5326425
ChEMBL: n/a
InChI Key: OUUSPVSSNHLIGE-AGYLCKTBSA-N
SMILES: CC(=CCC1C(O1)(C)C2C(C(CCC2(C)O)OC(=O)NC(=O)CCl)OC)C

ClassyFire chemical classification:

List of proteins that are targets for TN4

# DrugDomain Data UniProt Accession Drug Action Affinity data
1 Q8SR45_TN4 Q8SR45 n/a
2 P50579_TN4 P50579 inhibitor Ki(nM) = 1.0
IC50(nM) = 1.0
3 P53582_TN4 P53582 n/a