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Target
Monoglyceride lipase
Ligand
BDBM50569386
Substrate
n/a
Meas. Tech.
ChEMBL_2109228 (CHEMBL4817903)
Kd
710±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:
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:
BDBM50569386
Synonyms:
CHEMBL1356127
Type:
Small organic molecule
Emp. Form.:
C25H30N4O2S
Mol. Mass.:
450.596
SMILES:
COc1ccc(cc1)N1CCN(CC1)C(=O)c1ccc2nc(sc2c1)N1CCC(C)CC1
Structure:
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