Ligand name: (2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl 3,4,5-trihydroxybenzoate
PDB ligand accession: KDH
DrugBank: DB12116
PubChem: 65064
ChEMBL: CHEMBL297453
InChI Key: WMBWREPUVVBILR-WIYYLYMNSA-N
SMILES: c1c(cc(c(c1O)O)O)C2C(Cc3c(cc(cc3O2)O)O)OC(=O)c4cc(c(c(c4)O)O)O

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Flavonoids
      • Subclass: Flavans

List of proteins that are targets for DB12116

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P26358_KDH	P26358	inhibitor
2	C3W5S0_KDH	C3W5S0	n/a
3	P02766_KDH	P02766	n/a
4	Q13526_KDH	Q13526	n/a
5	P63316_KDH	P63316	n/a
6	J7HDY4_KDH	J7HDY4	n/a
7	P35869_KDH	P35869	n/a
8	Q86XF0_KDH	Q86XF0	n/a