Ki Summary

Reaction Details

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Target

Monoglyceride lipase

Ligand

BDBM581625

Substrate/Competitor

n/a

Meas. Tech.

Biological Assay

IC50

0.230±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:

Type:

Hydrolase

Mol. Mass.:

33264.56

Organism:

Homo sapiens (Human)

Description:

Human recombinant MGL (Cayman Chemical, cat# 10008354).

Residue:

303

Sequence:

MPEESSPRRTPQSIPYQDLPHLVNADGQYLFCRYWKPTGTPKALIFVSHGAGEHSGRYEE
LARMLMGLDLLVFAHDHVGHGQSEGERMVVSDFHVFVRDVLQHVDSMQKDYPGLPVFLLG
HSMGGAIAILTAAERPGHFAGMVLISPLVLANPESATTFKVLAAKVLNLVLPNLSLGPID
SSVLSRNKTEVDIYNSDPLICRAGLKVCFGIQLLNAVSRVERALPKLTVPFLLLQGSADR
LCDSKGAYLLMELAKSQDKTLKIYEGAYHVLHKELPEVTNSVFHEINMWVSQRTATAGTA
SPP

BDBM581625

n/a

Name

BDBM581625

Synonyms:

(rac)-(2s,4s)-8-Methyl-2-(2-(4-(trifluoromethyl)phenyl)-8-azaspiro[4.5]decane-8- carbonyl)-7-oxa-5-azaspiro[3.4]octan-6-one | US11505546, Example 40

Type

Small organic molecule

Emp. Form.

C24H29F3N2O3

Mol. Mass.

450.4939

SMILES

CC1OC(=O)N[C@@]11C[C@@H](C1)C(=O)N1CCC2(CCC(C2)c2ccc(cc2)C(F)(F)F)CC1 |r,wU:8.11,wD:6.10,(-5.45,-3.04,;-6.61,-1.89,;-8.12,-2.21,;-8.89,-.87,;-10.43,-.87,;-7.86,.27,;-6.45,-.35,;-4.96,-.75,;-4.56,.73,;-6.05,1.13,;-3.23,1.5,;-3.23,3.04,;-1.9,.73,;-1.9,-.81,;-.56,-1.58,;.77,-.81,;.77,-2.35,;2.24,-2.82,;3.14,-1.58,;2.24,-.33,;4.63,-1.18,;5.72,-2.27,;7.21,-1.87,;7.6,-.38,;6.52,.71,;5.03,.31,;9.09,.02,;10.43,.79,;9.49,1.51,;10.43,-.75,;.77,.73,;-.56,1.5,)|

Structure