ZYH
Monoacylglycerol lipase (human-MGLL) inhibitor
General
Type : Piperazine, Pyrimidine, Azetidin, Benzoxazol
Chemical_Nomenclature : (2-cyclohexyl-1,3-benzoxazol-6-yl)-[3-(4-pyrimidin-2-ylpiperazin-1-yl)azetidin-1-yl]methanone
Canonical SMILES : C1CCC(CC1)C2=NC3=C(O2)C=C(C=C3)C(=O)N4CC(C4)N5CCN(CC5)C6=NC=CC=N6
InChI : InChI=1S\/C25H30N6O2\/c32-24(19-7-8-21-22(15-19)33-23(28-21)18-5-2-1-3-6-18)31-16-20(17-31)29-11-13-30(14-12-29)25-26-9-4-10-27-25\/h4,7-10,15,18,20H,1-3,5-6,11-14,16-17H2
InChIKey : IABLYMUVWHQTGC-UHFFFAOYSA-N
Other name(s) : SCHEMBL3776406 || 2-Cyclohexyl-1,3-Benzoxazol-6-Yl){3-[4-(Pyrimidin-2-Yl)piperazin-1-Yl]azetidin-1-Yl}methanone
MW : 446.54
Formula : C25H30N6O2
CAS_number :
PubChem : 45279979
UniChem : IABLYMUVWHQTGC-UHFFFAOYSA-N
Target
Families : ZYH ligand of proteins in family
Monoglyceridelipase_lysophospholip
Structure :
3PE6
Protein :
human-MGLL
References (2)
| Title : Monoglyceride lipase: Structure and inhibitors - Scalvini_2016_Chem.Phys.Lipids_197_13 |
| Author(s) : Scalvini L , Piomelli D , Mor M |
| Ref : Chemistry & Physic of Lipids , 197 :13 , 2016 |
| Abstract : |
| PubMedSearch : Scalvini_2016_Chem.Phys.Lipids_197_13 |
| PubMedID: 26216043 |
| Title : Crystal structure of a soluble form of human monoglyceride lipase in complex with an inhibitor at 1.35 A resolution - Schalk-Hihi_2011_Protein.Sci_20_670 |
| Author(s) : Schalk-Hihi C , Schubert C , Alexander R , Bayoumy S , Clemente JC , Deckman I , Desjarlais RL , Dzordzorme KC , Flores CM , Grasberger B , Kranz JK , Lewandowski F , Liu L , Ma H , Maguire D , Macielag MJ , McDonnell ME , Mezzasalma Haarlander T , Miller R , Milligan C , Reynolds C , Kuo LC |
| Ref : Protein Science , 20 :670 , 2011 |
| Abstract : |
| PubMedSearch : Schalk-Hihi_2011_Protein.Sci_20_670 |
| PubMedID: 21308848 |
| Gene_locus related to this paper: human-MGLL |