CHEMBL106375
IC50 human-LIPE 0.02 microM
General
Type :
Chemical_Nomenclature : 2-[4-(3-fluorophenyl)piperidine-1-carbonyl]-4-(2-methoxyethyl)-3-methyl-1,2-oxazol-5-one
Canonical SMILES : CC1=C(C(=O)ON1C(=O)N2CCC(CC2)C3=CC(=CC=C3)F)CCOC
InChI : InChI=1S\/C19H23FN2O4\/c1-13-17(8-11-25-2)18(23)26-22(13)19(24)21-9-6-14(7-10-21)15-4-3-5-16(20)12-15\/h3-5,12,14H,6-11H2,1-2H3
InChIKey : QSQAUXAPFAEVSV-UHFFFAOYSA-N
Other name(s) : BDBM50147315 || 2-(4-(3-fluorophenyl)piperidine-1-carbonyl)-4-(2-methoxyethyl)-3-methylisoxazol-5(2H)-one || 2-[4-(3-Fluoro-phenyl)-piperidine-1-carbonyl]-4-(2-methoxy-ethyl)-3-methyl-2H-isoxazol-5-one
MW : 362.4
Formula : C19H23FN2O4
CAS_number :
PubChem : 44337241
UniChem : QSQAUXAPFAEVSV-UHFFFAOYSA-N
Target
Families : CHEMBL106375 ligand of proteins in family
Hormone-sensitive_lipase_like
Protein :
human-LIPE
References (2)
| Title : Combining ligand-based pharmacophore modeling, quantitative structure-activity relationship analysis and in silico screening for the discovery of new potent hormone sensitive lipase inhibitors - Taha_2008_J.Med.Chem_51_6478 |
| Author(s) : Taha MO , Dahabiyeh LA , Bustanji Y , Zalloum H , Saleh S |
| Ref : Journal of Medicinal Chemistry , 51 :6478 , 2008 |
| Abstract : |
| PubMedSearch : Taha_2008_J.Med.Chem_51_6478 |
| PubMedID: 18808096 |
| Title : In vitro SAR of (5-(2H)-isoxazolonyl) ureas, potent inhibitors of hormone-sensitive lipase - Lowe_2004_Bioorg.Med.Chem.Lett_14_3155 |
| Author(s) : Lowe DB , Magnuson S , Qi N , Campbell AM , Cook J , Hong Z , Wang M , Rodriguez M , Achebe F , Kluender H , Wong WC , Bullock WH , Salhanick AI , Witman-Jones T , Bowling ME , Keiper C , Clairmont KB |
| Ref : Bioorganic & Medicinal Chemistry Lett , 14 :3155 , 2004 |
| Abstract : |
| PubMedSearch : Lowe_2004_Bioorg.Med.Chem.Lett_14_3155 |
| PubMedID: 15149665 |
| Gene_locus related to this paper: human-LIPE |