Ligand name: 1-ethyl-3-[5-[2-[(1S,5R)-3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl]-5-(2-oxidanylidene-3H-1,3,4-oxadiazol-5-yl)pyridin-3-yl]-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridin-2-yl]urea
PDB ligand accession: 54B
DrugBank: n/a
PubChem: 134812606
ChEMBL: n/a
InChI Key: IDALGTCHRLCQSK-GASCZTMLSA-N
SMILES: CCNC(=O)Nc1cc(c(cn1)c2cc(cnc2N3C4CCC3CN(C4)C)C5=NNC(=O)O5)c6nc(cs6)C(F)(F)F

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazinanes
      • Subclass: Piperazines

List of proteins that are targets for 54B

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	G6JAH7_54B	G6JAH7	n/a