Reaction Details Report a problem with these data
Target
Monoglyceride lipase
Ligand
BDBM483868
Substrate
n/a
Meas. Tech.
In Vitro Competitive Activity-Based Protein Profiling
IC50
<100±n/a nM
Citation
 Grice, CA; Wiener, JJ; Weber, OD; Duncan, KK Pyrazole MAGL inhibitors US Patent  US10927105 Publication Date 2/23/2021 
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:
BDBM483868
Synonyms:
1-(7-(2,5- dichlorobenzyl)-2,7- diazaspiro[4.4]- nonane-2-carbonyl)-N- methyl-1H-pyrazole-3- carboxamide | US10927105, Ex 428 | US11655217, Example 428
Type:
Small organic molecule
Emp. Form.:
C20H23Cl2N5O2
Mol. Mass.:
436.335
SMILES:
CNC(=O)c1ccn(n1)C(=O)N1CCC2(CCN(Cc3cc(Cl)ccc3Cl)C2)C1
Structure:
Search PDB for entries with ligand similarity: