1093100-40-3

1093100-40-3 structure

Name: B-Raf inhibitor 1
Chemical Name: 1-N-(4-chlorophenyl)-6-methyl-5-N-[3-(7H-purin-6-yl)pyridin-2-yl]isoquinoline-1,5-diamine
CAS Number: 1093100-40-3
Molecular Formula: C₂₆H₁₉ClN₈
Molecular Weight: 478.936
Catalog: Research Areas Cancer
Create Date: 2016-01-19 12:36:17
Modify Date: 2024-01-02 18:42:11
B-Raf inhibitor 1 is a potent Raf kinase inhibitor with Kis of 1 nM, 1 nM, and 0.3 nM for B-RafWT, B-RafV600E, and C-Raf, respectively.

Name	1-N-(4-chlorophenyl)-6-methyl-5-N-[3-(7H-purin-6-yl)pyridin-2-yl]isoquinoline-1,5-diamine
Synonyms	L1E B-Raf inhibitor 1 N-(4-Chlorophenyl)-6-methyl-N-[3-(1H-purin-6-yl)-2-pyridinyl]-1,5-isoquinolinediamine 1,5-Isoquinolinediamine, N-(4-chlorophenyl)-6-methyl-N-[3-(9H-purin-6-yl)-2-pyridinyl]- 3idp pyridylpurine aminoisoquinoline,1

Description	B-Raf inhibitor 1 is a potent Raf kinase inhibitor with Kis of 1 nM, 1 nM, and 0.3 nM for B-RafWT, B-RafV600E, and C-Raf, respectively.
Related Catalog	Research Areas >> Cancer
Target	B-Raf:1 nM (Ki) B-RafV600E:1 nM (Ki) c-Raf:0.3 nM (Ki)
In Vitro	B-Raf inhibitor 1 (Compound 13) inhibits A375 and HCT-116 proliferation with IC50s of 0.31 and 0.72 μM, respectively. B-Raf inhibitor 1 (Compound 13) binds to and stabilizes B-Raf in a DFG-out, inactive conformation in which the ATP pocket is partially filled by Phe595 and Gly596 from the DFG motif. B-Raf inhibitor 1 (Compound 13) additionally exhibits low micromolar inhibition against wild type B-Raf cell lines, which may be due to off-target kinase activities or alternatively to pan-Raf inhibition, including Raf dimers[1].
References	[1]. Wang X, et al. Conformation-specific effects of Raf kinase inhibitors. J Med Chem. 2012 Sep 13;55(17):7332-41.