Reaction Details | |||
---|---|---|---|
Report a problem with these data | |||
Target | Monoglyceride lipase | ||
Ligand | BDBM581646 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | Biological Assay | ||
IC50 | 0.170±n/a nM | ||
Citation | Alcazar, J; Ameriks, MK; Berry, CB; Garcia-Reynaga, P; Samant, AV; Vega-Ramiro, JA Azaspirocycles as monoacylglycerol lipase modulators US Patent US11505546 Publication Date 11/22/2022 | ||
More Info.: | Get all data from this article, Assay Method | ||
Monoglyceride lipase | |||
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: |
| ||
BDBM581646 | |||
n/a | |||
Name | BDBM581646 | ||
Synonyms: | (rac)-(2s,4s)-2-(6-(3-Isopropylphenyl)-2-azaspiro[3.4]octane-2-carbonyl)-7-oxa-5- azaspiro[3.4]octan-6-one | US11505546, Example 61 | ||
Type | Small organic molecule | ||
Emp. Form. | C23H30N2O3 | ||
Mol. Mass. | 382.4959 | ||
SMILES | CC(C)c1cccc(c1)C1CCC2(CN(C2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)C1 |r,wU:18.19,wD:20.22,(9.48,-2.44,;7.95,-2.55,;7.28,-3.94,;7.08,-1.28,;7.75,.11,;6.88,1.38,;5.35,1.27,;4.68,-.12,;5.54,-1.39,;3.14,-.23,;2.24,-1.48,;.77,-1,;.77,.54,;-.72,.14,;-1.11,1.63,;.37,2.03,;-2.45,2.4,;-2.45,3.94,;-3.78,1.63,;-4.18,.14,;-5.67,.54,;-5.27,2.03,;-5.59,-1,;-7.03,-1.55,;-7.99,-.35,;-9.48,-.22,;-7.16,.94,;2.24,1.01,)| | ||
Structure |