Diflapolin
human-EPHX2 IC50 0.02 microM
General
Type : Urea derivative, Multitarget, Thiazole, FLAP inhibitor, Organochlorine
Chemical_Nomenclature : 1-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methylphenyl]-3-(3,4-dichlorophenyl)urea
Canonical SMILES : CC1=C(C=CC(=C1)OCC2=NC3=CC=CC=C3S2)NC(=O)NC4=CC(=C(C=C4)Cl)Cl
InChI : InChI=1S\/C22H17Cl2N3O2S\/c1-13-10-15(29-12-21-26-19-4-2-3-5-20(19)30-21)7-9-18(13)27-22(28)25-14-6-8-16(23)17(24)11-14\/h2-11H,12H2,1H3,(H2,25,27,28)
InChIKey : FGXLEECGXSDIMM-UHFFFAOYSA-N
Other name(s) : 1-(4-(benzo[d]thiazol-2-ylmethoxy)-2-methylphenyl)-3-(3,4-dichlorophenyl)urea || CHEMBL4291038 || MFCD04092440 || orb129858 || SCHEMBL20103602
MW : 458.4
Formula : C22H17Cl2N3O2S
CAS_number : 724453-98-9
PubChem : 4560409
UniChem : FGXLEECGXSDIMM-UHFFFAOYSA-N
Target
Families : Diflapolin ligand of proteins in family
Epoxide_hydrolase
Protein :
human-EPHX2
mouse-hyes
References (6)
| Title : Synthesis, Biological Evaluation and Structure-Activity Relationships of Diflapolin Analogues as Dual sEH\/FLAP Inhibitors - Vieider_2019_ACS.Med.Chem.Lett_10_62 |
| Author(s) : Vieider L , Romp E , Temml V , Fischer J , Kretzer C , Schoenthaler M , Taha A , Hernandez-Olmos V , Sturm S , Schuster D , Werz O , Garscha U , Matuszczak B |
| Ref : ACS Med Chem Lett , 10 :62 , 2019 |
| Abstract : |
| PubMedSearch : Vieider_2019_ACS.Med.Chem.Lett_10_62 |
| PubMedID: 30655948 |
| Title : Synthesis, Biological Evaluation and Structure-Activity Relationships of Diflapolin Analogues as Dual sEH\/FLAP Inhibitors - Vieider_2019_ACS.Med.Chem.Lett_10_62 |
| Author(s) : Vieider L , Romp E , Temml V , Fischer J , Kretzer C , Schoenthaler M , Taha A , Hernandez-Olmos V , Sturm S , Schuster D , Werz O , Garscha U , Matuszczak B |
| Ref : ACS Med Chem Lett , 10 :62 , 2019 |
| Abstract : |
| PubMedSearch : Vieider_2019_ACS.Med.Chem.Lett_10_62 |
| PubMedID: 30655948 |
| Title : Synthesis, Biological Evaluation and Structure-Activity Relationships of Diflapolin Analogues as Dual sEH\/FLAP Inhibitors - Vieider_2019_ACS.Med.Chem.Lett_10_62 |
| Author(s) : Vieider L , Romp E , Temml V , Fischer J , Kretzer C , Schoenthaler M , Taha A , Hernandez-Olmos V , Sturm S , Schuster D , Werz O , Garscha U , Matuszczak B |
| Ref : ACS Med Chem Lett , 10 :62 , 2019 |
| Abstract : |
| PubMedSearch : Vieider_2019_ACS.Med.Chem.Lett_10_62 |
| PubMedID: 30655948 |
| Title : Discovery of the first dual inhibitor of the 5-lipoxygenase-activating protein and soluble epoxide hydrolase using pharmacophore-based virtual screening - Temml_2017_Sci.Rep_7_42751 |
| Author(s) : Temml V , Garscha U , Romp E , Schubert G , Gerstmeier J , Kutil Z , Matuszczak B , Waltenberger B , Stuppner H , Werz O , Schuster D |
| Ref : Sci Rep , 7 :42751 , 2017 |
| Abstract : |
| PubMedSearch : Temml_2017_Sci.Rep_7_42751 |
| PubMedID: 28218273 |
| Title : Discovery of the first dual inhibitor of the 5-lipoxygenase-activating protein and soluble epoxide hydrolase using pharmacophore-based virtual screening - Temml_2017_Sci.Rep_7_42751 |
| Author(s) : Temml V , Garscha U , Romp E , Schubert G , Gerstmeier J , Kutil Z , Matuszczak B , Waltenberger B , Stuppner H , Werz O , Schuster D |
| Ref : Sci Rep , 7 :42751 , 2017 |
| Abstract : |
| PubMedSearch : Temml_2017_Sci.Rep_7_42751 |
| PubMedID: 28218273 |
| Title : Discovery of the first dual inhibitor of the 5-lipoxygenase-activating protein and soluble epoxide hydrolase using pharmacophore-based virtual screening - Temml_2017_Sci.Rep_7_42751 |
| Author(s) : Temml V , Garscha U , Romp E , Schubert G , Gerstmeier J , Kutil Z , Matuszczak B , Waltenberger B , Stuppner H , Werz O , Schuster D |
| Ref : Sci Rep , 7 :42751 , 2017 |
| Abstract : |
| PubMedSearch : Temml_2017_Sci.Rep_7_42751 |
| PubMedID: 28218273 |