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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.

Term:SGC-CLK-1
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Accession:CHEBI:156443 term browser browse the term
Definition:A pyrazolopyridazine that is pyrazolo[1,5-b]pyridazine which is substituted by a 2-[3-methoxy-5-(trifluoromethyl)anilino]pyrimidin-4-yl group at position 3 and by a methoxy group at position 6. It is a human GSK-3beta, CDK2, CDK4, CLK1, CLK2, and CLK4 kinase inhibitor.
Synonyms:exact_synonym: 4-(6-methoxypyrazolo[1,5-b]pyridazin-3-yl)-N-[3-methoxy-5-(trifluoromethyl)phenyl]pyrimidin-2-amine
 related_synonym: Formula=C19H15F3N6O2;   InChI=1S/C19H15F3N6O2/c1-29-13-8-11(19(20,21)22)7-12(9-13)25-18-23-6-5-15(26-18)14-10-24-28-16(14)3-4-17(27-28)30-2/h3-10H,1-2H3,(H,23,25,26);   InChIKey=GJYVLTPTDBQQCY-UHFFFAOYSA-N;   SMILES=COC1=CC(NC2=NC=CC(=N2)C2=C3C=CC(OC)=NN3N=C2)=CC(=C1)C(F)(F)F
 xref: PMID:15341487


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        NMR chemical shift reference compound 0
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            organic amino compound 0
              secondary amino compound 0
                SGC-CLK-1 0
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                                        fluoromethanes 0
                                          tetrafluoromethane 0
                                            trifluoromethyl group 0
                                              (trifluoromethyl)benzenes 0
                                                SGC-CLK-1 0
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