Reaction Details Report a problem with these data
Target
Monoglyceride lipase
Ligand
BDBM50514172
Substrate
n/a
Meas. Tech.
ChEMBL_1855765 (CHEMBL4356494)
IC50
230±n/a nM
Citation
 Castelli, R; Scalvini, L; Vacondio, F; Lodola, A; Anselmi, M; Vezzosi, S; Carmi, C; Bassi, M; Ferlenghi, F; Rivara, S; Møller, IR; Rand, KD; Daglian, J; Wei, D; Dotsey, EY; Ahmed, F; Jung, KM; Stella, N; Singh, S; Mor, M; Piomelli, D Benzisothiazolinone Derivatives as Potent Allosteric Monoacylglycerol Lipase Inhibitors That Functionally Mimic Sulfenylation of Regulatory Cysteines. J Med Chem 63:1261-1280 (2020) [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:
BDBM50514172
Synonyms:
CHEMBL4536072
Type:
Small organic molecule
Emp. Form.:
C19H20N4O2S2
Mol. Mass.:
400.518
SMILES:
O=c1n(NCCCCCNn2sc3ccccc3c2=O)sc2ccccc12
Structure:
Search PDB for entries with ligand similarity: