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CHEBI:189659 - PF-06446846

ChEBI IDCHEBI:189659
ChEBI NamePF-06446846
Stars
DefinitionA triazolopyridine that is 3H-[1,2,3]triazolo[4,5-b]pyridine substituted by a 4-{(3-chloropyridin-2-yl)[(3R)-piperidin-3-yl]carbamoyl}phenyl group at position 3. It is a potent inhibitor of PCSK9.
Last Modified7 February 2022
Submitterjinyangd
DownloadsMolfile
FormulaC22H20ClN7O
Net Charge0
Average Mass433.903
Monoisotopic Mass433.14179
SMILESO=C(c1ccc(-n2nnc3cccnc32)cc1)N(c1ncccc1Cl)[C@@H]1CCCNC1
InChIInChI=1S/C22H20ClN7O/c23-18-5-2-12-25-20(18)29(17-4-1-11-24-14-17)22(31)15-7-9-16(10-8-15)30-21-19(27-28-30)6-3-13-26-21/h2-3,5-10,12-13,17,24H,1,4,11,14H2/t17-/m1/s1
InChIKeyFDTXHWQFIXYHCL-QGZVFWFLSA-N
Roles Classification
Biological Role:
EC 3.4.21.61 (kexin) inhibitor  An EC 3.4.21.* (serine endopeptidase) inhibitor that interferes with the action of kexin (EC 3.4.21.61).
Application:
antilipemic drug  A substance used to treat hyperlipidemia (an excess of lipids in the blood).
ChEBI Ontology
Outgoing Relation(s)
PF-06446846 (CHEBI:189659) has role antilipemic drug (CHEBI:35679)
PF-06446846 (CHEBI:189659) has role EC 3.4.21.61 (kexin) inhibitor (CHEBI:189665)
PF-06446846 (CHEBI:189659) is a benzamides (CHEBI:22702)
PF-06446846 (CHEBI:189659) is a monochloropyridine (CHEBI:39172)
PF-06446846 (CHEBI:189659) is a piperidines (CHEBI:26151)
PF-06446846 (CHEBI:189659) is a tertiary carboxamide (CHEBI:140326)
PF-06446846 (CHEBI:189659) is a triazolopyridine (CHEBI:46746)
IUPAC Name 
N-(3-chloropyridin-2-yl)-N-[(3R)-piperidin-3-yl]-4-(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yl)benzamide
Synonyms  Source
PF06446846ChEBI
PF 06446846ChEBI
PF-06446846ChEBI
PF-846ChEBI
Manual XrefsDatabases
74849329ChemSpider
MVMPDBeChem
US9227956Patent
Registry NumbersSources
CAS:1632250-49-7ChEBI
Citations