CHEBI:143111 - ({6-[4-(methylsulfanyl)phenyl]thieno[3,2-d]pyrimidin-4-yl}sulfanyl)acetic acid

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ChEBI Name ({6-[4-(methylsulfanyl)phenyl]thieno[3,2-d]pyrimidin-4-yl}sulfanyl)acetic acid
ChEBI ID CHEBI:143111
ChEBI ASCII Name ({6-[4-(methylsulfanyl)phenyl]thieno[3,2-d]pyrimidin-4-yl}sulfanyl)acetic acid
Definition A thienopyrimidine that is thieno[3,2-d]pyrimidine which is substituted by a (carboxymethyl)sulfanediyl group at position 4 and by a 4-(methylsulfanyl)phenyl group at position 6. It is a STK17B kinase inhibitor.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Tim Willson
Supplier Information
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Formula C15H12N2O2S3
Net Charge 0
Average Mass 348.450
Monoisotopic Mass 348.00609
InChI InChI=1S/C15H12N2O2S3/c1-20-10-4-2-9(3-5-10)12-6-11-14(22-12)15(17-8-16-11)21-7-13(18)19/h2-6,8H,7H2,1H3,(H,18,19)
InChIKey KJCQGDBVLKOAHP-UHFFFAOYSA-N
SMILES OC(CSC1=C2C(C=C(C3=CC=C(SC)C=C3)S2)=NC=N1)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor
An EC 2.7.11.* (protein-serine/threonine kinase) inhibitor that interferes with the action of non-specific serine/threonine protein kinase (EC 2.7.11.1), a kinase enzyme involved in phosphorylation of hydroxy group of serine or threonine.
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ChEBI Ontology
Outgoing ({6-[4-(methylsulfanyl)phenyl]thieno[3,2-d]pyrimidin-4-yl}sulfanyl)acetic acid (CHEBI:143111) has role EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor (CHEBI:50925)
({6-[4-(methylsulfanyl)phenyl]thieno[3,2-d]pyrimidin-4-yl}sulfanyl)acetic acid (CHEBI:143111) is a aryl sulfide (CHEBI:35683)
({6-[4-(methylsulfanyl)phenyl]thieno[3,2-d]pyrimidin-4-yl}sulfanyl)acetic acid (CHEBI:143111) is a monocarboxylic acid (CHEBI:25384)
({6-[4-(methylsulfanyl)phenyl]thieno[3,2-d]pyrimidin-4-yl}sulfanyl)acetic acid (CHEBI:143111) is a sulfur-containing carboxylic acid (CHEBI:33576)
({6-[4-(methylsulfanyl)phenyl]thieno[3,2-d]pyrimidin-4-yl}sulfanyl)acetic acid (CHEBI:143111) is a thienopyrimidine (CHEBI:143212)
IUPAC Name
({6-[4-(methylsulfanyl)phenyl]thieno[3,2-d]pyrimidin-4-yl}sulfanyl)acetic acid
Synonym Source
UNC-AP-141 ChEBI
Citation Waiting for Citations Type Source
21862328 PubMed citation Europe PMC
Last Modified
07 March 2019
Submitter Remark
2019-02-19 19:16:21.0 Tim Willson STK17B kinase inhibitor