NIK SMI1 free base
NIK SMI1 is a highly potent and selective NF-κB-inducing kinase inhibitor.
For research use only. Not for human or veterinary use.
NIK SMI1 structure
CAS No.: 1660114-31-7
Pack sizes & pricing
| Size | Price | SKU | Stock | |
|---|---|---|---|---|
| 100 mg | USD 600.00 | BP-02148-100mg | In stock | Get quote |
| 250 mg | USD 1,150.00 | BP-02148-250mg | In stock | Get quote |
| 500 mg | USD 1,800.00 | BP-02148-500mg | In stock | Get quote |
| 1 g | USD 2,800.00 | BP-02148-1g | In stock | Get quote |
Need another size or custom synthesis? Request a quote.
Description
NIK SMI1 is a highly potent and selective NF-κB-inducing kinase (NIK) inhibitor with Ki of 0.23 nM for NIK-catalyzed hydrolysis of ATP to ADP.
Biological activity
In Vitro NIK SMI1 (Compound 4f) inhibits NIK-catalyzed hydrolysis of ATP to ADP (fluorescence polarization, FP) with an IC50 of 0.23±0.17 nM. NIK SMI1 inhibits the expression of NIK SMI1 response elementregulated firefly luciferase reporter gene in HEK293 cells with an IC50 of 34±6 nM. Consistent with expectations for a NIK inhibitor, NIK SMI1 is shown to inhibit nuclear translocation of p52 (RelB) (IC50=70 nM). NIK SMI1 inhibits BAFF-induced B cell (mouse) survival in vitro with an IC50 of 373±64 nM. n Vivo C57BL/6 mice are treated twice daily for 7 days with orally administered NIK SMI1 or with three injections of recombinant BAFF receptor fusion protein (Br3- mIgG2a) over the course of the 7-day experiment as a positive control. The nonlinearity of exposure relative to dose between 100 and 200 mg/kg is a result of saturation of clearance mechanisms. The pharmacology of NIK SMI1 is examined in SD rat, CD-1 mouse, beagle, and cynomologous monkey with 20, 32, 18, and 7.8 mL/kg per min, respectively. Volume of distribution (Vd, L/kg) is 1.35, 1.58, 0.778, and 1.39, respectively.
Identifiers
- SMILES
-
O=C(N)C1=NC(C2=CC=CC(C#C[C@]3(O)CCN(C)C3=O)=C2)=CC(OC)=C1 - InChIKey
-
LQSHXYHWYGKAMX-FQEVSTJZSA-N
Specifications
- MW (average)
- 365.3826
- Formula
- C20H19N3O4
- CAS No.
- 1660114-31-7
- Physical state
- Solid
- Color
- off-white to pink
- Shipping
- Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
- Storage
- Powder 4℃ 2 years; In solvent -20℃ 1 month;
Solubility
Soluble in DMSO