Reaction Details Report a problem with these data
Target
Monoglyceride lipase
Ligand
BDBM50552713
Substrate
n/a
Meas. Tech.
ChEMBL_2035356 (CHEMBL4689514)
IC50
0.070000±n/a nM
Citation
 Sabnis, RW Novel Oxazine Monoacylglycerol Lipase (MAGL) Inhibitors. ACS Med Chem Lett 12:312-313 (2021) [PubMed]  Article 
Target
Name:
Monoglyceride lipase
Synonyms:
HU-K5 | Lysophospholipase homolog | Lysophospholipase-like | MAGL | MGL | MGLL | MGLL_HUMAN
Type:
Hydrolase
Mol. Mass.:
33264.56
Organism:
Homo sapiens (Human)
Description:
Human recombinant MGL (Cayman Chemical, cat# 10008354).
Residue:
303
Sequence:
MPEESSPRRTPQSIPYQDLPHLVNADGQYLFCRYWKPTGTPKALIFVSHGAGEHSGRYEELARMLMGLDLLVFAHDHVGHGQSEGERMVVSDFHVFVRDVLQHVDSMQKDYPGLPVFLLGHSMGGAIAILTAAERPGHFAGMVLISPLVLANPESATTFKVLAAKVLNLVLPNLSLGPIDSSVLSRNKTEVDIYNSDPLICRAGLKVCFGIQLLNAVSRVERALPKLTVPFLLLQGSADRLCDSKGAYLLMELAKSQDKTLKIYEGAYHVLHKELPEVTNSVFHEINMWVSQRTATAGTASPP
  
Inhibitor
Name:
BDBM50552713
Synonyms:
CHEMBL4745872
Type:
Small organic molecule
Emp. Form.:
C22H31N3O3
Mol. Mass.:
385.4998
SMILES:
[H][C@@]12CN(CC[C@]1([H])OCC(=O)N2)C(=O)N1CC(C1)c1ccc(CC(C)(C)C)cc1 |r|
Structure:
Search PDB for entries with ligand similarity: