Therapeutic Targets Database
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TTD Drug ID: DNC006412

Drug Information
NameELLAGIC ACID
SynonymsELLAGIC ACID
IndicationNot AvailableExperimental    
Structure

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InChI1S/C14H6O8/c15-5-1-3-7-8-4(14(20)22-11(7)9(5)17)2-6(16)10(18)12(8
)21-13(3)19/h1-2,15-18H
InChIKeyAFSDNFLWKVMVRB-UHFFFAOYSA-N
Canonical SMILESC1=C2C3=C(C(=C1O)O)OC(=O)C4=CC(=C(C(=C43)OC2=O)O)O    
CAS NumberCAS 476-66-4
TargetCarbonic anhydrase IInhibitor[1]
Carbonic anhydrase IIInhibitor[1]
Carbonic anhydrase IVInhibitor[1]
Carbonic anhydrase IXInhibitor[1]
Carbonic anhydrase VIInhibitor[1]
Carbonic anhydrase XIIInhibitor[1]
Carbonic anhydrase XIIIInhibitor[1]
Carbonic anhydrase XIVInhibitor[1]
Casein kinase II alphaInhibitor[2]
Glycogen synthase kinase-3 betaInhibitor[3]
Heat shock 70 kDa protein 1Inhibitor[4]
Mothers against decapentaplegic homolog 3Inhibitor[4]
Squalene monooxygenaseInhibitor[5]
Tyrosine-protein kinase SYKInhibitor[3]
Ref 1Bioorg Med Chem. 2010 Mar 15;18(6):2159-64. Epub 2010 Feb 6.Carbonic anhydrase inhibitors. Inhibition of mammalian isoforms I-XIV with a series of natural product polyphenols and phenolic acids. To Reference
Ref 2Bioorg Med Chem Lett. 2009 Jun 1;19(11):2920-3. Epub 2009 Apr 22.Structural insight into human CK2alpha in complex with the potent inhibitor ellagic acid. To Reference
Ref 3J Med Chem. 2006 Apr 20;49(8):2363-6.Identification of ellagic acid as potent inhibitor of protein kinase CK2: a successful example of a virtual screening application. To Reference
Ref 4Bioorg Med Chem Lett. 2010 Dec 15;20(24):7331-6. Epub 2010 Oct 21.In silico identification and biochemical evaluation of novel inhibitors of NRH:quinone oxidoreductase 2 (NQO2). To Reference
Ref 5J Nat Prod. 2001 Aug;64(8):1010-4.Ellagitannins and hexahydroxydiphenoyl esters as inhibitors of vertebrate squalene epoxidase. To Reference



 

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