CHEBI:140875 - SKLB-677

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ChEBI Name SKLB-677
ChEBI ID CHEBI:140875
Definition A member of the class of phenylureas that is urea in which one of the nitrogens has been substituted by a 5-tert-butyl-1,2-oxazol-3-yl group, while the other has been substituted by a 3-fluoro-4-hydroxyphenyl group, the hydroxy group has been converted to the corresponding 1H-pyrazolo[3,4-d]pyrimidin-4-yl ether. It is an FLT3 (fms-like tyrosine kinase 3)and Wnt/β-catenin signaling inhibitor.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Ceri
Supplier Information ChemicalBook:CB8474490, eMolecules:481798, Selleckchem:Biochanin-A(4-Methylgenistein), ZINC000018847037
Download Molfile XML SDF
Formula C19H18FN7O3
Net Charge 0
Average Mass 411.390
Monoisotopic Mass 411.14552
InChI InChI=1S/C19H18FN7O3/c1-19(2,3)14-7-15(27-30-14)25-18(28)24-10-4-5-13(12(20)6-10)29-17-11-8-23-26-16(11)21-9-22-17/h4-9H,1-3H3,(H,21,22,23,26)(H2,24,25,27,28)
InChIKey HYYTZUUXIPJLRY-UHFFFAOYSA-N
SMILES C=1C(=CC=C(C1F)OC2=C3C(=NC=N2)NN=C3)NC(NC4=NOC(=C4)C(C)(C)C)=O
Roles Classification
Biological Role(s): Wnt signalling inhibitor
A substance that inhibits any of the Wnt signalling pathway, a group of signal transduction pathways made of proteins that pass signals from outside of a cell through cell surface receptors to the inside of the cell.
tyrosine kinase inhibitor
Any protein kinase inhibitor that interferes with the action of tyrosine kinase.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing SKLB-677 (CHEBI:140875) has role tyrosine kinase inhibitor (CHEBI:38637)
SKLB-677 (CHEBI:140875) has role Wnt signalling inhibitor (CHEBI:78031)
SKLB-677 (CHEBI:140875) is a aromatic ether (CHEBI:35618)
SKLB-677 (CHEBI:140875) is a isoxazoles (CHEBI:55373)
SKLB-677 (CHEBI:140875) is a monofluorobenzenes (CHEBI:83575)
SKLB-677 (CHEBI:140875) is a phenylureas (CHEBI:134043)
SKLB-677 (CHEBI:140875) is a pyrazolopyrimidine (CHEBI:38669)
IUPAC Name
1-(5-tert-butyl-1,2-oxazol-3-yl)-3-[3-fluoro-4-(1H-pyrazolo[3,4-d]pyrimidin-4-yloxy)phenyl]urea
Citation Type Source
26497577 PubMed citation SUBMITTER
Last Modified
04 June 2018