ARRY-371797   

GtoPdb Ligand ID: 11095

Synonyms: ARRY-797 | ARRY371797 | ARRY797 | compound 7 [PMID: 19950901]
Compound class: Synthetic organic
Comment: ARRY-371797 is a clinical stage, oral, p38α (MAPK14)-selective kinase inhibitor that was originally developed by Array BioPharma (a Pfizer owned company since mid-2019) for anti-inflammatory and analgesic potential [2]. However, development for chronic inflammatory diseases has since been terminated. No results from completed analgesia trials have been published. Subsequent repositioning has seen the focus transfer to ARRY-371797 for LMNA-related dilated cardiomyopathy. p38α signalling is hyperactivated in mice with cardiomyopathy caused by lamin A/C gene (LMNA) mutation [3] and p38α activation is observed in the hearts from human subjects with LMNA-related dilated cardiomyopathy, thus ARRY-371797 has been advanced as a therapeutic option for this indication.
2D Structure
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Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 9
Topological polar surface area 59.39
Molecular weight 416.2
XLogP 4.09
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Canonical SMILES CN(CCNC(=O)c1cc2c(cc1Oc1ccc(cc1F)F)cnn2CC(C)C)C
Isomeric SMILES CN(CCNC(=O)c1cc2c(cc1Oc1ccc(cc1F)F)cnn2CC(C)C)C
InChI InChI=1S/C22H26F2N4O2/c1-14(2)13-28-19-11-17(22(29)25-7-8-27(3)4)21(9-15(19)12-26-28)30-20-6-5-16(23)10-18(20)24/h5-6,9-12,14H,7-8,13H2,1-4H3,(H,25,29)
InChI Key IFGWYHGYNVGVRB-UHFFFAOYSA-N
Classification
Compound class Synthetic organic
IUPAC Name
-(2,4-difluorophenoxy)-N-[2-(dimethylamino)ethyl]-1-(2-methylpropyl)indazole-6-carboxamide
Synonyms
ARRY-797 | ARRY371797 | ARRY797 | compound 7 [PMID: 19950901]
Database Links
ChEMBL Ligand CHEMBL1088750
GtoPdb PubChem SID 434122156
PubChem CID 46883775
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