iFSP1 (CHEBI:176501)

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ChEBI Name	iFSP1

ChEBI ID	CHEBI:176501

Definition	A member of the class of pyridobenzimidazoles that is pyrido[1,2-a]benzimidazole substituted by amino, cyano, 4-methylphenyl, and cyano groups at positions 1, 2, 3 and 4, respectively. It is a potent inhibitor of ferroptosis suppressor protein 1 (FSP1) with EC₅₀ of 103 nM. It induces ferroptosis in GPX4 knockout cells that overexpress FSP1.

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	Ceara Rea

Supplier Information

Download	Molfile XML SDF

Formula

C20H13N5

Net Charge

Average Mass

323.359

Monoisotopic Mass

323.11710

InChI

InChI=1S/C20H13N5/c1-12-6-8-13(9-7-12)18-14(10-21)19(23)25-17-5-3-2-4-16(17)24-20(25)15(18)11-22/h2-9H,23H2,1H3

InChIKey

FNESYDFRCQEEKA-UHFFFAOYSA-N

SMILES

CC1=CC=C(C=C1)C1=C(C#N)C2=NC3=CC=CC=C3N2C(N)=C1C#N

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):	ferroptosis suppressor protein 1 inhibitor An inhibitor which inhibits the action of ferroptosis suppressor protein 1. ferroptosis inducer Any substance that induces or promotes ferroptosis (a type of programmed cell death dependent on iron and characterized by the accumulation of lipid peroxides) in organisms.

Application(s):	antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

ChEBI Ontology
Outgoing	iFSP1 (CHEBI:176501) has role antineoplastic agent (CHEBI:35610) iFSP1 (CHEBI:176501) has role ferroptosis inducer (CHEBI:173085) iFSP1 (CHEBI:176501) has role ferroptosis suppressor protein 1 inhibitor (CHEBI:176508) iFSP1 (CHEBI:176501) is a aromatic amine (CHEBI:33860) iFSP1 (CHEBI:176501) is a nitrile (CHEBI:18379) iFSP1 (CHEBI:176501) is a primary amino compound (CHEBI:50994) iFSP1 (CHEBI:176501) is a pyridobenzimidazole (CHEBI:176507) iFSP1 (CHEBI:176501) is a toluenes (CHEBI:27024)

IUPAC Name

1-amino-3-(4-methylphenyl)pyrido[1,2-a]benzimidazole-2,4-dicarbonitrile

Synonyms	Sources
1-amino-3-(p-tolyl)benzo[4,5]imidazo[1,2-a]pyridine-2,4-dicarbonitrile	ChEBI
iFSP 1	ChEBI
iFSP-1	ChEBI

Registry Number	Type	Source
150651-39-1	CAS Registry Number	ChEBI

Last Modified

14 June 2021