Ligand name: IBUPROFEN
PDB ligand accession: IBP
DrugBank: DB09213
PubChem: 39912
ChEMBL: CHEMBL175
InChI Key: HEFNNWSXXWATRW-JTQLQIEISA-N
SMILES: CC(C)Cc1ccc(cc1)C(C)C(=O)O

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Phenylpropanoic acids
      • Subclass: None

List of proteins that are targets for DB09213

#	DrugDomain Data	UniProt Accession	Protein name	Drug Action	Affinity data
1	P35747_IBP	P35747	Albumin (allergen Equ	n/a
2	P23219_IBP	P23219	Prostaglandin G/H synthase	inhibitor	IC50(nM) = 99.0
3	P46059_IBP	P46059	Solute carrier family	n/a
4	P02768_IBP	P02768	Albumin	n/a
5	P13569_IBP	P13569	Cystic fibrosis transmembrane	inhibitor
6	P24627_IBP	P24627	Lactotransferrin (Lactoferrin) (EC	n/a
7	Q05769_IBP	Q05769	Prostaglandin G/H synthase	n/a
8	P15090_IBP	P15090	Fatty acid-binding protein,	n/a
9	P05413_IBP	P05413	Fatty acid-binding protein,	n/a
10	P52895_IBP	P52895	Aldo-keto reductase family	n/a	IC50(nM) = 42400.0
11	P35354_IBP	P35354	Prostaglandin G/H synthase	inhibitor	IC50(nM) = 730.0
12	P37231_IBP	P37231	Peroxisome proliferator-activated receptor	activator
13	Q07869_IBP	Q07869	Peroxisome proliferator-activated receptor	n/a
14	P10415_IBP	P10415	Apoptosis regulator Bcl-2	negative modulator
15	P07359_IBP	P07359	Platelet glycoprotein Ib	n/a
16	F7BAY6_IBP	F7BAY6	Albumin	n/a
17	P05979_IBP	P05979	Prostaglandin G/H synthase	n/a	IC50(nM) = 2260.0
18	P12104_IBP	P12104	Fatty acid-binding protein,	binder
19	P07204_IBP	P07204	Thrombomodulin (TM) (Fetomodulin)	modulator
20	Q08AH3_IBP	Q08AH3	Acyl-coenzyme A synthetase	n/a
21	P59071_IBP	P59071	Basic phospholipase A2	n/a
22	P00750_IBP	P00750	Tissue-type plasminogen activator	modulator
23	Q05320_IBP	Q05320	Envelope glycoprotein (GP1,2)	n/a
24	P31151_IBP	P31151	Protein S100-A7 (Psoriasin)	n/a