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Inhibitor Report for: Benzothiazole-analogue-13f

dual inhibitor of FAAH (not aB-hydrolase) and sEH: IC50 (nM) 1.8 (FAAH) 8.7 (sEH)


General
Type Benzothiazol, Piperidine, Sulfur Compound, Sulfonamide, Carboxamide
Chemical_Nomenclature 1-(2-chlorophenyl)sulfonyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]piperidine-4-carboxamide
Canonical SMILES CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4CCN(CC4)S(=O)(=O)C5=CC=CC=C5Cl
InChI InChI=1S/C26H24ClN3O3S2/c1-17-6-11-22-23(16-17)34-26(29-22)19-7-9-20(10-8-19)28-25(31)18-12-14-30(15-13-18)35(32,33)24-5-3-2-4-21(24)27/h2-11,16,18H,12-15H2,1H3,(H,28,31)
InChIKey HPMYEWNJGYVDEY-UHFFFAOYSA-N
Other name(s) benzothiazole analogue, 13f ; CHEMBL468258 ; BDBM26714 ; Compound 6H
________________________________________________________________________________________________
MW|526.1
Formula|C26H24ClN3O3S2
CAS_number|
PubChem|25187407
UniChem|HPMYEWNJGYVDEY-UHFFFAOYSA-N
IUPHAR|
Wikipedia|

Target
Families | Benzothiazole-analogue-13f ligand of proteins in family: Epoxide_hydrolase
Protein | human-EPHX2

References:
Search PubMed for references concerning: Benzothiazole-analogue-13f
    Title: Further exploration of the structure-activity relationship of dual soluble epoxide hydrolase/fatty acid amide hydrolase inhibitors
    Wilt S, Kodani S, Valencia L, Hudson PK, Sanchez S, Quintana T, Morisseau C, Hammock BD, Kandasamy R, Pecic S
    Ref: Bioorganic & Medicinal Chemistry, 51:116507, 2021 : PubMed