Reaction Details Report a problem with these data
Target
Monoglyceride lipase
Ligand
BDBM609878
Substrate
n/a
Meas. Tech.
Biological Assay
IC50
0.075±n/a nM
Citation
 Ameriks, MK; Berry, CB; Garcia-Reynaga, P; Laforteza, BN; Liang, JT Monoacylglycerol lipase modulators US Patent  US11708359 Publication Date 7/25/2023 
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:
BDBM609878
Synonyms:
(rac)-(2s,4s)-2-(6-(3-Chloro-4-methylphenyl)-3- azabicyclo[4.1.0]heptane-3-carbonyl)-7-oxa-5-azaspiro[3.4]octan-6-one | US11708359, Example 67
Type:
Small organic molecule
Emp. Form.:
C20H23ClN2O3
Mol. Mass.:
374.861
SMILES:
Cc1ccc(cc1Cl)C12CC1CN(CC2)C(=O)[C@H]1C[C@@]2(C1)COC(=O)N2 |r,wU:17.19,wD:19.22,(6.36,-4.59,;5.59,-3.26,;4.05,-3.26,;3.28,-1.93,;4.05,-.59,;5.59,-.59,;6.36,-1.93,;7.9,-1.93,;3.28,.74,;4.62,1.51,;3.28,2.28,;1.95,3.05,;.62,2.28,;.62,.74,;1.95,-.03,;-.72,3.05,;-.72,4.59,;-2.05,2.28,;-2.45,.79,;-3.94,1.19,;-3.54,2.68,;-4.1,-.34,;-5.6,-.66,;-6.37,.68,;-7.9,.84,;-5.34,1.82,)|
Structure:
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