Ligand name: N-{trans-4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl}-4-{[(7R)-7-ethyl-5-methyl-8-(1-methylethyl)-6-oxo-5,6,7,8-tetrahydropteridin-2-yl]amino}-3-methoxybenzamide
PDB ligand accession: IBI
DrugBank: DB12062
PubChem: n/a
ChEMBL: CHEMBL1233528
InChI Key: SXNJFOWDRLKDSF-STROYTFGSA-N
SMILES: CCC1C(=O)N(c2cnc(nc2N1C(C)C)Nc3ccc(cc3OC)C(=O)NC4CCC(CC4)N5CCN(CC5)CC6CC6)C

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pteridines and derivatives
      • Subclass: None

List of proteins that are targets for IBI

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P48426_IBI	P48426	n/a
2	U3KQA6_IBI	U3KQA6	n/a
3	P53350_IBI	P53350	inhibitor
4	Q58F21_IBI	Q58F21	n/a
5	O60885_IBI	O60885	n/a