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BDBM50531985 CHEMBL4463252

SMILES: Oc1cc(ccc1Br)C(=O)N1CCC(CC1)C(=O)c1ccc(Cl)cc1

InChI Key: InChIKey=ITHRRHVJXKNCGU-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50531985   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Monoglyceride lipase


(Homo sapiens (Human))
BDBM50531985
PNG
(CHEMBL4463252)
Show SMILES Oc1cc(ccc1Br)C(=O)N1CCC(CC1)C(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C19H17BrClNO3/c20-16-6-3-14(11-17(16)23)19(25)22-9-7-13(8-10-22)18(24)12-1-4-15(21)5-2-12/h1-6,11,13,23H,7-10H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 457n/an/an/an/an/an/a



University of Pisa

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAGL using 4-NPA as substrate after 30 mins


J Med Chem 62: 1932-1958 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01483
More data for this
Ligand-Target Pair