| Identification | Back Directory | [Name]
Acetic acid, 2-(5,7,8,9-tetrahydro-5-hydroxy-2-phenyl-6H-benzocyclohepten-6-ylidene)-, (2E)- | [CAS]
2368927-41-5 | [Synonyms]
Acetic acid, 2-(5,7,8,9-tetrahydro-5-hydroxy-2-phenyl-6H-benzocyclohepten-6-ylidene)-, (2E)- | [Molecular Formula]
C19H18O3 | [MOL File]
2368927-41-5.mol | [Molecular Weight]
294.34 |
| Hazard Information | Back Directory | [Description]
Ph-HTBA a Novel High-Affinity Brain-Penetrant Stabilizer of the CaMKIIα Hub Domain. Ph-HTBA showed enhanced mid-nanomolar affinity for the CaMKIIα binding site and a marked hub thermalstabilization effect along with a distinct CaMKIIα Trp403 flip upon binding. Moreover, Ph-HTBA has good cellular permeability and low microsomal clearance and shows brain permeability after systemic administration to mice, signified by a high Kp, uu value (0.85). Ph-HTBA is a promising candidate for CaMKIIα-associated pharmacological interventions and future clinical development. | [Uses]
Ph-HTBA is a high-affinity, brain-penetrating modulator for CaMKIIα. Ph-HTBA has binding affinity for CaMKIIα with a Kd value of 757 nM. Ph-HTBA can be used for the research of ischemia and neurodegenerative disorders[1]. | [in vivo]
Ph-HTBA has good cellular permeability and low microsomal clearance and shows brain permeability after systemic administration to mice[1]. | [References]
[1] Yongsong Tian,et al. Exploring the NCS-382 Scaffold for CaMKIIα Modulation: Synthesis, Biochemical Pharmacology, and Biophysical Characterization of Ph-HTBA as a Novel High-Affinity Brain-Penetrant Stabilizer of the CaMKIIα Hub Domain. J Med Chem. 2022 Nov 8. DOI:10.1021/acs.jmedchem.2c00805 |
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