alectinib (Q21099132)

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chemical compound

AF802
Alecensa®
CH5424802
CH 5424802
AF-802
AF 802
Alecensa
9-ethyl-6,6-dimethyl-8-[4-(morpholin-4-yl)piperidin-1-yl]-11-oxo-6,11-dihydro-5H-benzo[b]carbazole-3-carbonitrile
Alectinib

Language	Label	Description	Also known as
English	alectinib	chemical compound	AF802 Alecensa® CH5424802 CH 5424802 AF-802 AF 802 Alecensa 9-ethyl-6,6-dimethyl-8-[4-(morpholin-4-yl)piperidin-1-yl]-11-oxo-6,11-dihydro-5H-benzo[b]carbazole-3-carbonitrile Alectinib

Statements

type of chemical entity

0 references

chemical compound

0 references

0 references

1 reference

https://www.chemicalprobes.org/ch5424802

chemical structure

Alectinib skeletal.svg
1,980 × 1,030; 20 KB

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482.268 dalton

1 reference

language of work or name

Alectinib (English)

19 October 2016

chemical formula

C₃₀H₃₄N₄O₂

1 reference

language of work or name

Alectinib (English)

20 November 2016

canonical SMILES

CCC1=C(C=C2C(=C1)C(=O)C3=C(C2(C)C)NC4=C3C=CC(=C4)C#N)N5CCC(CC5)N6CCOCC6

1 reference

language of work or name

Alectinib (English)

20 November 2016

active ingredient in

1 reference

14 February 2018

World Health Organisation international non-proprietary name

alectinib (English)

1 reference

language of work or name

alectinib (English)

19 October 2016

medical condition treated

non-small-cell lung carcinoma

1 reference

Drug Indications Extracted from FAERS

2 October 2018

physically interacts with

subject has role

reaction inhibitor

1 reference

Open Targets Platform

14 August 2023

https://platform.opentargets.org/drug/CHEMBL1738797

ALK receptor tyrosine kinase

subject has role

reaction inhibitor

1 reference

Open Targets Platform

14 August 2023

https://platform.opentargets.org/drug/CHEMBL1738797

LiverTox likelihood score

LiverTox toxicity likelihood category D

1 reference

8 April 2021

https://www.ncbi.nlm.nih.gov/books/n/livertox/Alectinib

30 May 2017

Commons category

Alectinib

0 references

Identifiers

InChI=1S/C30H34N4O2/c1-4-20-16-23-24(17-26(20)34-9-7-21(8-10-34)33-11-13-36-14-12-33)30(2,3)29-27(28(23)35)22-6-5-19(18-31)15-25(22)32-29/h5-6,15-17,21,32H,4,7-14H2,1-3H3

1 reference

language of work or name

Alectinib (English)

20 November 2016

KDGFLJKFZUIJMX-UHFFFAOYSA-N

2 references

language of work or name

Alectinib (English)

20 November 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

Global Substance Registration System

language of work or name

alectinib (English)

20 November 2016

KDGFLJKFZUIJMX-UHFFFAOYSA-N

CAS Common Chemistry

9 April 2021

https://commonchemistry.cas.org/detail?cas_rn=1256580-46-7

1 reference

language of work or name

Alectinib (English)

20 November 2016

2 references

language of work or name

Alectinib (English)

20 November 2016

matched by identifier from

KDGFLJKFZUIJMX-UHFFFAOYSA-N

Reaxys registry number

22302431

1 reference

language of work or name

alectinib (English)

19 October 2016

mapping relation type

2 references

language of work or name

alectinib (English)

19 October 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C30H34N4O2/c1-4-20-16-23-24(17-26(20)34-9-7-21(8-10-34)33-11-13-36-14-12-33)30(2,3)29-27(28(23)35)22-6-5-19(18-31)15-25(22)32-29/h5-6,15-17,21,32H,4,7-14H2,1-3H3

1 reference

language of work or name

ALECTINIB (English)

20 November 2016

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

KDGFLJKFZUIJMX-UHFFFAOYSA-N

UniChem compound ID

1 reference

DSSTox substance ID

2 references

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

matched by identifier from

KDGFLJKFZUIJMX-UHFFFAOYSA-N

DSSTOX compound identifier

0 references

0 references

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

9-ethyl-6,6-dimethyl-8-(4-morpholinopiperidin-1-yl)-11-oxo-6,11-dihydro-5H-benzo[b]carbazole-3-carbonitrile (English)

CAS no.: 1256580-46-7 (English)

ECHA Substance Infocard ID

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

9-ethyl-6,6-dimethyl-8-(4-morpholinopiperidin-1-yl)-11-oxo-6,11-dihydro-5H-benzo[b]carbazole-3-carbonitrile (English)

CAS no.: 1256580-46-7 (English)

0 references

Guide to Pharmacology Ligand ID

1 reference

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

language of work or name

alectinib (English)

20 November 2016

MeSH descriptor ID

subject named as

alectinib

0 references

1 reference

Global Substance Registration System

language of work or name

alectinib (English)

20 November 2016

1 reference

matched by identifier from

KDGFLJKFZUIJMX-UHFFFAOYSA-N

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

KDGFLJKFZUIJMX-UHFFFAOYSA-N

2 references

Global Substance Registration System

language of work or name

alectinib (English)

20 November 2016

matched by identifier from

KDGFLJKFZUIJMX-UHFFFAOYSA-N

MedlinePlus drug identifier

0 references

PatientsLikeMe treatment ID

0 references

1 reference

Global Substance Registration System

language of work or name

alectinib (English)

20 November 2016

Probes And Drugs ID

0 references

1 reference

1 reference

language of work or name

alectinib (English)

19 October 2016

0 references

Google Knowledge Graph ID

0 references

Microsoft Academic ID

0 references

1 reference

26 January 2022

https://docs.openalex.org/download-snapshot/snapshot-data-format

PDB structure ID

1 reference

Protein Data Bank

PDB structure ID

language of work or name

3AOX (English)

19 October 2016

1 reference

Global Substance Registration System

language of work or name

alectinib (English)

20 November 2016

1 reference

based on heuristic

inferred by common MeSH mappings on source and on Wikidata

25 May 2023

WikiProjectMed ID

0 references

Sitelinks

Wikipedia(10 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(1 entry)

commonswiki Category:Alectinib

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