CHEBI:82713 - SB220025

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name SB220025
Definition Am member of the class of imidazoles carrying piperidin-4-yl, 4-fluophenyl and 2-aminopyrimidin-4-yl substituents at posiitons 1, 4 and 5 respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Matthias Ziehm
Supplier Information
Download Molfile XML SDF
Formula C18H19FN6
Net Charge 0
Average Mass 338.38210
Monoisotopic Mass 338.16552
InChI InChI=1S/C18H19FN6/c19-13-3-1-12(2-4-13)16-17(15-7-10-22-18(20)24-15)25(11-23-16)14-5-8-21-9-6-14/h1-4,7,10-11,14,21H,5-6,8-9H2,(H2,20,22,24)
SMILES Nc1nccc(n1)-c1c(ncn1C1CCNCC1)-c1ccc(F)cc1
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): EC (mitogen-activated protein kinase) inhibitor
An EC 2.7.11.* (protein-serine/threonine kinase) inhibitor that interferes with the action of mitogen-activated protein kinase (EC
Application(s): angiogenesis inhibitor
An agent and endogenous substances that antagonize or inhibit the development of new blood vessels.
anti-inflammatory agent
Any compound that has anti-inflammatory effects.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing SB220025 (CHEBI:82713) has role angiogenesis inhibitor (CHEBI:48422)
SB220025 (CHEBI:82713) has role anti-inflammatory agent (CHEBI:67079)
SB220025 (CHEBI:82713) has role EC (mitogen-activated protein kinase) inhibitor (CHEBI:79091)
SB220025 (CHEBI:82713) is a aminopyrimidine (CHEBI:38338)
SB220025 (CHEBI:82713) is a imidazoles (CHEBI:24780)
SB220025 (CHEBI:82713) is a organofluorine compound (CHEBI:37143)
SB220025 (CHEBI:82713) is a piperidines (CHEBI:26151)
Synonyms Sources
SB 220025 ChEBI
SB-220025 ChEBI
Manual Xrefs Databases
DB04338 DrugBank
SB4 PDBeChem
View more database links
Registry Number Type Source
9007200 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
22138711 PubMed citation Europe PMC
9454815 PubMed citation Europe PMC
Last Modified
25 September 2014