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Takinib - ≥98%(HPLC), high purity , CAS No.1111556-37-6, Inhibitor of CDC like kinase 2;Inhibitor of interleukin 1 receptor associated kinase 1;Inhibitor of interleukin 1 receptor associated kinase 4;Inhibitor of mitogen-activated protein kinase kinase kinase 7

Moligand™

≥98%(HPLC)

CAS#: 1111556-37-6
Molecular Weight: 322.37
EC Number: 841-675-9
PubChem CID: 37750349
PubChem SID: 504770128

In stock

Item Number

T288176

Grouped product items
SKU	Size	Availability	Price
T288176-5mg	5mg	3	$78.90
T288176-10mg	10mg	2	$147.90
T288176-25mg	25mg	2	$333.90
T288176-50mg	50mg	2	$444.90
T288176-100mg	100mg	2	$741.90

Potent and selective TAK1/MAP3K7 kinase inhibitor

View related series

CDC like kinase 2 Inhibitor (10) interleukin 1 receptor associated kinase 1 Inhibitor (6) interleukin 1 receptor associated kinase 4 Inhibitor (15) MAP3K (30) MAPK/ERK Pathway (541) mitogen-activated protein kinase kinase kinase 7 Inhibitor (11)

Basic Description

Synonyms	N17080 \| SCHEMBL20063046 \| F0918-1884 \| A928060 \| Tox21_300612 \| Diethyl phthalate, 99% \| NSC789624 \| NSC-789624 \| UNII-Z56NTB3YHJ \| CCG-267729 \| Z332866662 \| 1-N-(1-propyl-1H-1,3-benzodiazol-2-yl)benzene-1,3-dicarboxamide \| AKOS037515558 \| GTPL9655 \| MFC
Specifications & Purity	Moligand™, ≥98%(HPLC)
Biochemical and Physiological Mechanisms	Potent and selective TAK1/MAP3K7 kinase inhibitor (IC50= 8.2-9.5 nM). Selective for TAK1 over IRAK4, IRAK1, GCK, CLK2 and MINK1 (IC50values = 120, 390, 430, 430 and 1900 nM, respectively). Demonstrates weak inhibition at Src and Yes1. Exhibits no inhibiti
Storage Temp	Store at -20°C
Shipped In	Ice chest + Ice pads
Grade	Moligand™
Action Type	INHIBITOR
Mechanism of action	Inhibitor of CDC like kinase 2;Inhibitor of interleukin 1 receptor associated kinase 1;Inhibitor of interleukin 1 receptor associated kinase 4;Inhibitor of mitogen-activated protein kinase kinase kinase 7
Product Description	Application Takinib has been used as an inhibitor of transforming 28 growth factor - β-activated kinase -1 (TAK-1) in human leukemia monocytic THP-1 cells. It may be used as a TAK1 inhibitor in Jurkat cells.

Associated Targets(Human)

IRAK4 Tchem Interleukin-1 receptor-associated kinase 4 (1 Activities)

Discover Target: IRAK4

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

IRAK1 Tchem Interleukin-1 receptor-associated kinase 1 (1 Activities)

Discover Target: IRAK1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

MAP3K7 Tchem Mitogen-activated protein kinase kinase kinase 7 (1 Activities)

Discover Target: MAP3K7

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

CLK2 Tchem Dual specificity protein kinase CLK2 (1 Activities)

Discover Target: CLK2

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

Names and Identifiers

Pubchem Sid	504770128
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504770128
IUPAC Name	3-N-(1-propylbenzimidazol-2-yl)benzene-1,3-dicarboxamide
INCHI	InChI=1S/C18H18N4O2/c1-2-10-22-15-9-4-3-8-14(15)20-18(22)21-17(24)13-7-5-6-12(11-13)16(19)23/h3-9,11H,2,10H2,1H3,(H2,19,23)(H,20,21,24)
InChi Key	UOZVVPXKJGOFIG-UHFFFAOYSA-N
Canonical SMILES	CCCN1C2=CC=CC=C2N=C1NC(=O)C3=CC=CC(=C3)C(=O)N
Isomeric SMILES	CCCN1C2=CC=CC=C2N=C1NC(=O)C3=CC=CC(=C3)C(=O)N
Alternate CAS	1111556-37-6
PubChem CID	37750349
MeSH Entry Terms	EDHS-206;takinib
Molecular Weight	322.37

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

5 results found

Lot Number	Certificate Type	Date	Item
C2301328	Certificate of Analysis	Sep 06, 2022	T288176
C2301329	Certificate of Analysis	Sep 06, 2022	T288176
C2301325	Certificate of Analysis	Sep 06, 2022	T288176
C2301326	Certificate of Analysis	Sep 06, 2022	T288176
C2301324	Certificate of Analysis	Sep 06, 2022	T288176

Chemical and Physical Properties

Solubility	Solvent:DMSO, Max Conc. mg/mL: 32.24, Max Conc. mM: 100
Molecular Weight	322.400 g/mol
XLogP3	2.300
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	322.143 Da
Monoisotopic Mass	322.143 Da
Topological Polar Surface Area	90.000 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	470.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Safety and Hazards(GHS)

Pictogram(s)	GHS07
Signal	Warning
Hazard Statements	H315:Causes skin irritation H319:Causes serious eye irritation H335:May cause respiratory irritation H302:Harmful if swallowed
Precautionary Statements	P261:Avoid breathing dust/fume/gas/mist/vapors/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P405:Store locked up. P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P271:Use only outdoors or in a well-ventilated area. P270:Do not eat, drink or smoke when using this product. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P403+P233:Store in a well-ventilated place. Keep container tightly closed. P362+P364:Take off contaminated clothing and wash it before reuse. P330:Rinse mouth. P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes. P301+P317:IF SWALLOWED: Get medical help. P337+P317:If eye irritation persists: Get medical help. P332+P317:If skin irritation occurs: Get medical help. P319:Get medical help if you feel unwell.
RIDADR	NONHforallmodesoftransport

Specifications

Specification Sheet

FAQs and Articles

PANoptosis: An inflammatory programmed cell death pathway

Categories: Technical articles

Tags:

PAN apoptosis

References

1. Totzke J, Gurbani D, Raphemot R, Hughes PF, Bodoor K, Carlson DA, Loiselle DR, Bera AK, Eibschutz LS, Perkins MM et al.. (2017) Takinib, a Selective TAK1 Inhibitor, Broadens the Therapeutic Efficacy of TNF-α Inhibition for Cancer and Autoimmune Disease.. Cell Chem Biol, 24 (8): (1029-1039.e7). [PMID:28820959] [10.1021/op500134e]
2. Scarneo SA, Mansourati A, Eibschutz LS, Totzke J, Roques JR, Loiselle D, Carlson D, Hughes P, Haystead TAJ. (2018) Genetic and pharmacological validation of TAK1 inhibition in macrophages as a therapeutic strategy to effectively inhibit TNF secretion.. Sci Rep, 8 (1): (17058). [PMID:30451876] [10.1021/op500134e]

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