Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with Target = 'Monoglyceride lipase' and Ligand = 'BDBM50470454'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Monoglyceride lipase (Homo sapiens (Human))	BDBM50470454 (CHEMBL4282040) Show SMILES Oc1cccc(c1)C(=O)N1CCC(CC1)C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C19H18ClNO3/c20-16-6-4-13(5-7-16)18(23)14-8-10-21(11-9-14)19(24)15-2-1-3-17(22)12-15/h1-7,12,14,22H,8-11H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PubMed	650	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Competitive inhibition of human recombinant MAGL using 4-NPA substrate incubated for 30 mins by Michaelis-Menten kinetics analysis				Citation and Details BindingDB Entry DOI: 10.7270/Q20868X2
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50470454 (CHEMBL4282040) Show SMILES Oc1cccc(c1)C(=O)N1CCC(CC1)C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C19H18ClNO3/c20-16-6-4-13(5-7-16)18(23)14-8-10-21(11-9-14)19(24)15-2-1-3-17(22)12-15/h1-7,12,14,22H,8-11H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	840	n/a	n/a	n/a	n/a	n/a	n/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 BindingDB Entry DOI: 10.7270/Q2GM8BSN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50470454 (CHEMBL4282040) Show SMILES Oc1cccc(c1)C(=O)N1CCC(CC1)C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C19H18ClNO3/c20-16-6-4-13(5-7-16)18(23)14-8-10-21(11-9-14)19(24)15-2-1-3-17(22)12-15/h1-7,12,14,22H,8-11H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	840	n/a	n/a	n/a	n/a	n/a	n/a
University of Pisa Curated by ChEMBL					Assay Description Inhibition of recombinant human C-terminal His-tagged MAGL expressed in Escherichia coli using 4-NPA as substrate measured after 30 mins				Eur J Med Chem 157: 817-836 (2018) Article DOI: 10.1016/j.ejmech.2018.08.038 BindingDB Entry DOI: 10.7270/Q2MS3WG9
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50470454 (CHEMBL4282040) Show SMILES Oc1cccc(c1)C(=O)N1CCC(CC1)C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C19H18ClNO3/c20-16-6-4-13(5-7-16)18(23)14-8-10-21(11-9-14)19(24)15-2-1-3-17(22)12-15/h1-7,12,14,22H,8-11H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PubMed	n/a	n/a	840	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human recombinant MAGL using 4-NPA substrate incubated for 30 mins				Citation and Details BindingDB Entry DOI: 10.7270/Q20868X2
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50470454 (CHEMBL4282040) Show SMILES Oc1cccc(c1)C(=O)N1CCC(CC1)C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C19H18ClNO3/c20-16-6-4-13(5-7-16)18(23)14-8-10-21(11-9-14)19(24)15-2-1-3-17(22)12-15/h1-7,12,14,22H,8-11H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	845	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human recombinant MAGL using 4-NPA as substrate by microplate reader method				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113679 BindingDB Entry DOI: 10.7270/Q2NV9P2Q
					More data for this Ligand-Target Pair