LY3214996 - Moligand™, 10mM in DMSO , Mitogen-activated protein kinase; ERK1/ERK2 inhibitor, CAS No.1951483-29-6, Mitogen-activated protein kinase; ERK1/ERK2 inhibitor

CAS: 1951483-29-6 Cat. No.: L408245 Formula: C₂₂H₂₇N₇O₂S Peso molecolare: 453.56

GRADE & PURITY Moligand™, 10mM in DMSO

Synonyms

4H-​Thieno[2,​3-​c]​pyrrol-​4-​one, 5,​6-​dihydro-​6,​6-​dimethyl-​2-​[2-​[(1-​methyl-​1H-​pyrazol-​5-​yl)​amino]​-​4-​pyrimidinyl]​-​5-​[2-​(4-​morpholinyl)​ethyl]​-

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Panoramica

Information

LY3214996 LY3214996 is a selective and novel ERK1/2 inhibitor with IC50 of 5 nM for both enzymes in biochemical assays. It potently inhibits cellular phospho-RSK1 in BRAF and RAS mutant cancer cell lines.
In vitro

In an unbiased tumor cell panel sensitivity profiling for inhibition of cell proliferation, tumor cells with MAPK pathway alterations including BRAF, NRAS or KRAS mutation are generally sensitivity to LY3214996. LY3214996 possesses an optimal balance of potency (hERK1 IC50 5 nM, hERK2 IC50 5nM, pRSK IC50 0.43 µM) and solubility.

In vivo

In tumor xenograft models, LY3214996 inhibits PD biomarker phospho-p90RSK1 in tumors and the PD effects are correlated with compound exposures and anti-tumor activities. LY3214996 shows either similar or superior anti-tumor activity as compared to other published ERK inhibitors in BRAF or RAS mutant cell lines and xenograft models. Oral administration of single-agent LY3214996 significantly inhibits tumor growth in vivo and is well tolerated in BRAF or NRAS mutant melanoma, BRAF or KRAS mutant colorectal, lung and pancreatic cancer xenografts or PDX models. In addition, LY3214996 has anti-tumor activity in a vemurafenib-resistant A375 melanoma xenograft model due to MAPK reactivation, may have potential for treatment of melanoma patients who have failed BRAF therapies. More importantly, LY3214996 can be combined with investigational and approved agents in preclinical models, particularly KRAS mutant models. Combination treatment of LY3214996 and CDK4/6 inhibitor abemaciclib is well tolerated and results in potent tumor growth inhibition or regression in multiple in vivo cancer models, including KRAS mutant colorectal and non-small cell lung cancers. LY3214996 has good PK properties (dog, AUCoral 23800 nM*hr, CL 12.1 mL/min/kg, bioavailability 75.4%), IVTI (TED50 =16 mg/kg pRSK1) and demonstrates significant in vivo efficacy in several human cancer xenograft models.
Cell Data

cell lines：

Concentrations：

Incubation Time：

Powder Purity:≥99%

Specifications

Sinonimi

4H-​Thieno[2,​3-​c]​pyrrol-​4-​one, 5,​6-​dihydro-​6,​6-​dimethyl-​2-​[2-​[(1-​methyl-​1H-​pyrazol-​5-​yl)​amino]​-​4-​pyrimidinyl]​-​5-​[2-​(4-​morpholinyl)​ethyl]​-

Specifiche e purezza

Moligand™, 10mM in DMSO

Meccanismi biochimici e fisiologici

LY3214996 is a selective and novel ERK1/2 inhibitor with IC50 of 5 nM for both enzymes in biochemical assays. It potently inhibits cellular phospho-RSK1 in BRAF and RAS mutant cancer cell lines.

Condizioni di conservazione di stoccaggio

Store at -80°C

Spedito in

Dry ice packs + Cold packs

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Grado

Moligand™

Tipo di azione

INHIBITOR

Meccanismo d'azione

Mitogen-activated protein kinase; ERK1/ERK2 inhibitor

Proprietà del prodotto

ALogP

2.664

hba_count

5

Conteggio HBD

1

Legame rotabile

6

Nomi e identificatori

Isomeri SMILES

CC1(C2=C(C=C(S2)C3=NC(=NC=C3)NC4=CC=NN4C)C(=O)N1CCN5CCOCC5)C

Peso molecolare

453.56

Reaxy-Rn

29638130

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=29638130&ln=

Proprietà chimiche e fisiche

• DMSO (mg/mL) Solubilità massima: 27
• DMSO (mM) Solubilità massima: 59.529059
• Acqua (mg/mL) Solubilità massima: ＜1

Domande frequenti

What is Moligand??

Moligand? is one of Aladdin Scientific's premium product lines, formulated for high-purity applications across multiple workflows. Compared to standard grades in the same workflow, Moligand? products typically offer tighter specifications, more rigorous QC, and stronger lot-to-lot consistency.

How should this product be stored?

Store at ?80 °C. Ultra-low temperature storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships frozen with dry ice and cold packs. Unpack on arrival and transfer it to the storage condition stated above; handle dry ice with insulated gloves in a ventilated area.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 1951483-29-6, the molecular formula is C22H27N7O2S, and the molecular weight is 453.56 g/mol.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.