Ligand name: [(3~{S})-3-[[(2~{S})-2-[(4-methoxy-1~{H}-indol-2-yl)carbonylamino]-4-methyl-pentanoyl]amino]-2-oxidanylidene-4-[(3~{R})-2-oxidanylidene-3,4-dihydropyrrol-3-yl]butyl] dihydrogen phosphate
PDB ligand accession: 80I
DrugBank: DB16514
PubChem: 154699467
ChEMBL: CHEMBL4802214
InChI Key: FQKALOFOWPDTED-WBAXXEDZSA-N
SMILES: CC(C)CC(C(=O)NC(CC1CCNC1=O)C(=O)COP(=O)(O)O)NC(=O)c2cc3c([nH]2)cccc3OC

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Indoles and derivatives
      • Subclass: Indolecarboxylic acids and derivatives

List of proteins that are targets for 80I

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P0C6U8_80I	P0C6U8	n/a
2	P0C6X5_80I	P0C6X5	n/a
3	T2BB45_80I	T2BB45	n/a
4	P0DTD1_80I	P0DTD1	inhibitor