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Inhibitor Report for: Tiratricol

Thyroid hormone anlogue. binds Thyroid hormone receptor, but also CFTR inhibitory factor Cif. Triiodothyroacetic acid is also a physiologic thyroid hormone that is present in the normal organism in low concentrations.


General
Type Natural, Drug, Thyroid hormone analogue
Chemical_Nomenclature 2-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]acetic acid
Canonical SMILES C1=CC(=C(C=C1OC2=C(C=C(C=C2I)CC(=O)O)I)I)O
InChI InChI=1S/C14H9I3O4/c15-9-6-8(1-2-12(9)18)21-14-10(16)3-7(4-11(14)17)5-13(19)20/h1-4,6,18H,5H2,(H,19,20)
InChIKey UOWZUVNAGUAEQC-UHFFFAOYSA-N
Other name(s) Triac ; 3,3',5-triodothyroacetic acid ; UNII-29OQ9EU4R1 ; CHEMBL41632 ; 4HY
________________________________________________________________________________________________
MW|621.93
Formula|C14H9I3O4
CAS_number|51-24-1
PubChem|5803
UniChem|UOWZUVNAGUAEQC-UHFFFAOYSA-N
IUPHAR|2637
Wikipedia|

Target
Families | Tiratricol ligand of proteins in family: CFTR-inhibitory-factor_Cif
Stucture | 1 structure: 4YX9: Crystal structure of the CFTR inhibitory factor Cif bound to tiratricol
Protein | pseae-PA2934

References:
Search PubMed for references concerning: Tiratricol
    Title: Rational Design of Potent and Selective Inhibitors of an Epoxide Hydrolase Virulence Factor from Pseudomonas aeruginosa
    Kitamura S, Hvorecny KL, Niu J, Hammock BD, Madden DR, Morisseau C
    Ref: Journal of Medicinal Chemistry, 59:4790, 2016 : PubMed

            

    Title: Inhibiting an Epoxide Hydrolase Virulence Factor from Pseudomonas aeruginosa Protects CFTR
    Bahl CD, Hvorecny KL, Bomberger JM, Stanton BA, Hammock BD, Morisseau C, Madden DR
    Ref: Angew Chem Int Ed Engl, 54:9881, 2015 : PubMed