selumetinib

CHEBI:90227 ·resolve ·ANTIVIRAL ·EXACT SEEDED

A member of the class of benzimidazoles that is 1-methyl-1H-benzimidazole which is substituted at positions 4, 5, and 6 by fluorine, (4-bromo-2-chlorophenyl)amino, and N-(2-hydroxyethoxy)aminocarbonyl groups, respectively. It is a MEK1 and MEK2 inhibitor. — ChEBI

Machine-generated and unreviewed. Identity, structure and cross-references come straight from ChEBI's and CARD's own data; no curator has signed off on this record yet.

Classification

Strictly broader compounds or drug classes this molecule belongs to.

CHEBI:22715 CHEBI:22715
CHEBI:37143 CHEBI:37143
CHEBI:37149 CHEBI:37149
CHEBI:50995 CHEBI:50995
CHEBI:75606 CHEBI:75606
CHEBI:83403 CHEBI:83403

Chemical structure

Computed structure properties
Molecular formula	C17H15BrClFN4O3
Charge	0
Average mass	457.687 Da
Monoisotopic mass	456.00001 Da
Source	ChEBI
InChIKey	CYOHGALHFOKKQC-UHFFFAOYSA-N

SMILES

Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(C(=O)NOCCO)cc21

InChI

InChI=1S/C17H15BrClFN4O3/c1-24-8-21-16-13(24)7-10(17(26)23-27-5-4-25)15(14(16)20)22-12-3-2-9(18)6-11(12)19/h2-3,6-8,22,25H,4-5H2,1H3,(H,23,26)

Also called

selumetinibum (INN)— chebi
sélumétinib (INN)— chebi
5-[(4-bromo-2-chlorophenyl)amino]-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-1H-benzimidazole-6-carboxamide (EXACT_SYNONYM)— chebi
ARRY 142886 (EXACT_SYNONYM)— chebi
ARRY-142886 (EXACT_SYNONYM)— chebi
ARRY142886 (EXACT_SYNONYM)— chebi
AZD 6244 (EXACT_SYNONYM)— chebi
AZD-6244 (EXACT_SYNONYM)— chebi
AZD6244 (EXACT_SYNONYM)— chebi

Cross-references

Equivalent identifiers for this same structure in other resources.

cas:606143-52-6
kegg.drug:D09666
lincs.smallmolecule:LSM-1056
pdb-ccd:3EW
reaxys:11099648
wikipedia.en:Selumetinib

Activity roles

Every antimicrobial role a source asserts for this compound — the unreduced evidence behind its antimicrobial_class.

CHEBI:149553 CHEBI:149553

Source concepts

Every upstream concept that resolved to this record. The merge is the product: this is what shows ChEBI and CARD are describing the same structure.

Upstream concepts merged into this record
Source	Native ID	Label	Minted CURIE	Version
CHEBI	`CHEBI:90227`	selumetinib	`antibioticmech:chebi-da5bc40c8a`	2026-08-30

Mechanism summary

Clinical status: APPROVED

Curation history

SEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Seeded from data/raw/ inventories (CHEBI)
RESEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Re-seeded from updated data/raw/ inventories
RESEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Re-seeded from updated data/raw/ inventories
RESEEDED_FROM_SOURCES 2026-08-31 · seed_from_sources
Re-seeded from updated data/raw/ inventories
RESEEDED_FROM_SOURCES 2026-08-31 · seed_from_sources
Re-seeded from updated data/raw/ inventories

Provenance

Seeded by scripts/seed_from_sources.py from the committed inventories in data/raw/. View the record.