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Target
Monoglyceride lipase
Ligand
BDBM50481947
Substrate
n/a
Meas. Tech.
ChEMBL_2109226 (CHEMBL4817901)
IC50
93±n/a nM
Citation
 Xiong, F; Ding, X; Zhang, H; Luo, X; Chen, K; Jiang, H; Luo, C; Xu, H Discovery of novel reversible monoacylglycerol lipase inhibitors via docking-based virtual screening. Bioorg Med Chem Lett 41:0 (2021) [PubMed]  Article 
Target
Name:
Monoglyceride lipase
Synonyms:
MAGL | MGLL_RAT | Mgl2 | Mgll | Monoacylglycerol lipase | Monoglyceride lipase | Monoglyceride lipase (MGL)
Type:
Enzyme
Mol. Mass.:
33505.38
Organism:
Rattus norvegicus (Rat)
Description:
Q8R431
Residue:
303
Sequence:
MPEASSPRRTPQNVPYQDLPHLVNADGQYLFCRYWKPSGTPKALIFVSHGAGEHCGRYDELAQMLKRLDMLVFAHDHVGHGQSEGERMVVSDFQVFVRDLLQHVNTVQKDYPEVPVFLLGHSMGGAISILAAAERPTHFSGMILISPLILANPESASTLKVLAAKLLNFVLPNISLGRIDSSVLSRNKSEVDLYNSDPLICHAGVKVCFGIQLLNAVSRVERAMPRLTLPFLLLQGSADRLCDSKGAYLLMESSPSQDKTLKMYEGAYHVLHKELPEVTNSVLHEINTWVSHRIAVAGARCLP
  
Inhibitor
Name:
BDBM50481947
Synonyms:
CHEBI:8416 | GNF-Pf-476 | PRISTIMERIN | Pristimerine | US11660306, Example Pristimerin | acs.jmedchem.1c00409_ST.332
Type:
Small organic molecule
Emp. Form.:
C30H40O4
Mol. Mass.:
464.6362
SMILES:
[H][C@@]12C[C@@](C)(CC[C@]1(C)CC[C@]1(C)C3=CC=C4C(C)=C(O)C(=O)C=C4[C@]3(C)CC[C@@]21C)C(=O)OC |r,c:24,t:14,16,19|
Structure:
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