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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Monoglyceride lipase' and Ligand = 'BDBM50049458'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Monoglyceride lipase


(Homo sapiens (Human))
BDBM50049458
PNG
(CHEMBL3318316)
Show SMILES C[C@H]1CCCC[C@@H]1NC(=O)CC[C@@H]1NC(=O)N(CCc2c[nH]c3ccc(F)cc23)C1=O |r|
Show InChI InChI=1S/C23H29FN4O3/c1-14-4-2-3-5-18(14)26-21(29)9-8-20-22(30)28(23(31)27-20)11-10-15-13-25-19-7-6-16(24)12-17(15)19/h6-7,12-14,18,20,25H,2-5,8-11H2,1H3,(H,26,29)(H,27,31)/t14-,18-,20-/m0/s1
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Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Jamia Hamdard (Hamdard University)

Curated by ChEMBL


Assay Description
Inhibition of human MAGL using 4-Nitrophenylacetate substrate incubated for 15 mins


Bioorg Med Chem Lett 24: 3986-96 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.029
BindingDB Entry DOI: 10.7270/Q2XP76J6
More data for this
Ligand-Target Pair