Adamantyl-urea-quinolyl-methyl-benzoate-Cpd11
dual 5-lipoxygenase (LOX)/soluble epoxide hydrolase (sEH) inhibitor IC50 LOX 300 nM; sEH 3.6 nM
General
Type : Adamantyl, Urea derivative, Quinoline, Benzoate, 5-Lipoxygenase inhibitor
Chemical_Nomenclature : p-[(6-{3-[(1-Adamantanyl)methyl]ureido}-1,2,3,4-tetrahydro-1-quinolyl)methyl]benzoic acid
Canonical SMILES : C1C3CC2CC1(CC(C2)C3)CNC(=O)NC4=CC=C5C(=C4)CCCN5CC6=CC=C(C=C6)C(O)=O
InChI : InChI=1S\/C29H35N3O3\/c33-27(34)23-5-3-19(4-6-23)17-32-9-1-2-24-13-25(7-8-26(24)32)31-28(35)30-18-29-14-20-10-21(15-29)12-22(11-20)16-29\/h3-8,13,20-22H,1-2,9-12,14-18H2,(H,33,34)(H2,30,31,35)
InChIKey : AEYHAVAHUIMMIX-UHFFFAOYSA-N
Other name(s) : compound 11 || 4-[(6-{3-[(adamantan-1-yl)methyl]urea}-3,4-dihydroquinolin-1(2H)-yl)methyl]benzoic acid
Target
Families : Adamantyl-urea-quinolyl-methyl-benzoate-Cpd11 ligand of proteins in family
Epoxide_hydrolase
Protein :
human-EPHX2
References (1)
| Title : Identification of a New, Potent, and Stable Tetrahydroquinoline-Based 5-LOX\/sEH Dual Inhibitor with Polymodal Anti-Inflammatory Activity in Acute Pancreatitis - D'Avino_2026_J.Med.Chem__ |
| Author(s) : D'Avino D , Ciaglia T , Jordan PM , Di Micco S , Musella S , Di Sarno V , Merciai F , Perna S , Smaldone G , Di Matteo F , Napolitano V , Stimoli R , Sardo I , Ricci O , Bifulco G , Sommella EM , Basilicata MG , Ferrara G , Roviezzo F , Di Dio A , Aquino G , Pellecchia S , Pepe G , Gomez-Monterrey IM , Campiglia P , Ostacolo C , Manfra M , Werz O , Rossi A , Bertamino A |
| Ref : Journal of Medicinal Chemistry , : , 2026 |
| Abstract : |
| PubMedSearch : D'Avino_2026_J.Med.Chem__ |
| PubMedID: 42504850 |
| Gene_locus related to this paper: human-EPHX2 |