saracatinib

CHEBI:47458 ·resolve ·ANTIVIRAL ·EXACT SEEDED

A member of the class of quinazolines that is quinazoline substituted by (5-chloro-2H-1,3-benzodioxol-4-yl)amino, (oxan-4-yl)oxy and 2-(4-methylpiperazin-1-yl)ethoxy groups at positions 4, 5 and 7, respectively. It is a dual inhibitor of the tyrosine kinases c-Src and Abl (IC50 = 2.7 and 30 nM, respectively). Saracatinib was originally developed by AstraZeneca for the treatment of cancer but in 2019 it was granted orphan drug designation by the US Food and Drug Administration for the treatment of idiopathic pulmonary fibrosis (IPF), a type of lung disease that results in scarring (fibrosis) of the lungs. — 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:35618 CHEBI:35618
CHEBI:36683 CHEBI:36683
CHEBI:38298 CHEBI:38298
CHEBI:38530 CHEBI:38530
CHEBI:46786 CHEBI:46786
CHEBI:46920 CHEBI:46920
CHEBI:46942 CHEBI:46942
CHEBI:50995 CHEBI:50995

Chemical structure

Computed structure properties
Molecular formula	C27H32ClN5O5
Charge	0
Average mass	542.036 Da
Monoisotopic mass	541.2092 Da
Source	ChEBI
InChIKey	OUKYUETWWIPKQR-UHFFFAOYSA-N

SMILES

CN1CCN(CCOc2cc(OC3CCOCC3)c3c(Nc4c(Cl)ccc5c4OCO5)ncnc3c2)CC1

InChI

InChI=1S/C27H32ClN5O5/c1-32-6-8-33(9-7-32)10-13-35-19-14-21-24(23(15-19)38-18-4-11-34-12-5-18)27(30-16-29-21)31-25-20(28)2-3-22-26(25)37-17-36-22/h2-3,14-16,18H,4-13,17H2,1H3,(H,29,30,31)

Also called

saracatinibum (INN)— chebi
N-(5-chloro-1,3-benzodioxol-4-yl)-7-[2-(4-methylpiperazin-1-yl)ethoxy]-5-(tetrahydro-2H-pyran-4-yloxy)quinazolin-4-amine (EXACT_SYNONYM)— chebi
AZ-10353926 (EXACT_SYNONYM)— chebi
AZD 0530 (EXACT_SYNONYM)— chebi
AZD-0530 (EXACT_SYNONYM)— chebi
AZD0530 (EXACT_SYNONYM)— chebi
N-(5-chloro-1,3-benzodioxol-4-yl)-7-[2-(4-methyl-1-piperazinyl)ethoxy]-5-[(tetrahydro-2H-pyran-4-yl)oxy]-4-quinazolinamine (EXACT_SYNONYM)— chebi
N-(5-chloro-2H-1,3-benzodioxol-4-yl)-7-[2-(4-methylpiperazin-1-yl)ethoxy]-5-[(oxan-4-yl)oxy]quinazolin-4-amine (EXACT_SYNONYM)— chebi

Cross-references

Equivalent identifiers for this same structure in other resources.

cas:379231-04-6
chemspider:8477917
drugbank:DB11805
kegg.drug:D09664
lincs.smallmolecule:LSM-1032
pdb-ccd:H8H
wikipedia.en:Saracatinib

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:47458`	saracatinib	`antibioticmech:chebi-112898a370`	2026-08-30

Molecular targets

The molecular entity or process this compound acts on. Each target carries evidence — this is a mechanistic claim, not a classification.

Orf1a protein VIRAL_PROTEIN MEASURED_TARGET_ASSOCIATION

BindingDB quantitative measurement in the named target organism; source assay descriptions and identifiers are retained per measurement. Evidence status: PRIMARY_EVIDENCE. Source: BINDINGDB 2026-09 (retrieved 2026-08-31).

Middle East respiratory syndrome-related coronavirus NCBITaxon:1335626

Quantitative measurements
Type	Reported value	Assay	BindingDB IDs	Reference
EC50	2900 nM	No assay is provided This is a review article.	`RSID 868966` `assay 8918_1` `monomer 12255`	`PMID:32852058`

Organism-specific examples
Protein	Gene	Organism	Entry
Orf1a protein `UniProtKB:A0A1L2E0X0`	—	Middle East respiratory syndrome-related coronavirus	UNREVIEWED

PMID:32852058 (BindingDB literature-curated quantitative target measurement; source value, assay text, reaction-set ID, and target organism retained.)

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

Provenance

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