Compile Data Set for Download or QSAR

Found 73 hits with Last Name = 'kimoto' and Initial = 'k'   

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))	BDBM50566988 (CHEMBL4860900) Show SMILES CC(Oc1ccc(F)cc1Cl)C1CCN(CC1)C(=O)[C@H]1C[C@@]2(C1)COC(=O)N2 |r,wD:19.20,21.30,(29.1,-8.47,;29.1,-6.93,;27.77,-6.16,;26.44,-6.93,;26.44,-8.46,;25.11,-9.23,;23.77,-8.45,;22.43,-9.22,;23.77,-6.91,;25.11,-6.15,;25.12,-4.61,;30.44,-6.17,;30.45,-4.63,;31.78,-3.87,;33.11,-4.64,;33.12,-6.18,;31.77,-6.94,;34.44,-3.87,;34.44,-2.33,;35.77,-4.63,;36.17,-6.12,;37.65,-5.72,;37.25,-4.24,;37.64,-7.27,;39.11,-7.75,;40.02,-6.51,;41.56,-6.51,;39.12,-5.26,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566987 (CHEMBL4854370) Show SMILES CC1(COc2ccc(F)cc2Cl)CCN(CC1)C(=O)[C@H]1C[C@@]2(C1)COC(=O)N2 |r,wD:19.20,21.30,(9.64,-8.98,;9.65,-7.45,;8.31,-8.21,;6.98,-7.44,;5.65,-8.2,;5.65,-9.73,;4.32,-10.5,;2.98,-9.73,;1.64,-10.49,;2.98,-8.19,;4.32,-7.42,;4.33,-5.88,;9.66,-5.9,;10.99,-5.14,;12.32,-5.92,;12.33,-7.45,;10.98,-8.22,;13.65,-5.15,;13.65,-3.61,;14.98,-5.91,;15.38,-7.4,;16.86,-7,;16.46,-5.51,;16.85,-8.54,;18.32,-9.02,;19.23,-7.78,;20.77,-7.79,;18.33,-6.53,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566989 (CHEMBL4872007) Show SMILES CCC(Oc1ccc(F)cc1Cl)C1CCN(CC1)C(=O)[C@H]1C[C@@]2(C1)COC(=O)N2 |r,wD:20.21,22.31,(48.05,-9.57,;49.39,-8.81,;49.4,-7.27,;48.07,-6.49,;46.73,-7.26,;46.73,-8.79,;45.4,-9.56,;44.06,-8.79,;42.72,-9.55,;44.07,-7.24,;45.4,-6.48,;45.41,-4.94,;50.73,-6.5,;50.74,-4.96,;52.07,-4.2,;53.4,-4.98,;53.41,-6.51,;52.07,-7.28,;54.73,-4.21,;54.73,-2.67,;56.06,-4.97,;56.46,-6.46,;57.95,-6.06,;57.55,-4.57,;57.94,-7.6,;59.4,-8.08,;60.31,-6.84,;61.85,-6.85,;59.41,-5.59,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.80	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566999 (CHEMBL4868762) Show SMILES FC(F)(F)c1ccc(COC2CN(C2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)cc1Cl |r,wD:16.16,18.26,(23.11,-7.75,;24.44,-8.52,;24.44,-10.06,;23.1,-9.28,;25.78,-7.75,;27.12,-8.53,;28.45,-7.76,;28.45,-6.22,;29.78,-5.46,;31.11,-6.23,;32.45,-5.47,;32.84,-3.98,;34.33,-4.39,;33.93,-5.87,;35.66,-3.62,;35.66,-2.08,;37,-4.39,;37.39,-5.87,;38.88,-5.47,;38.48,-3.98,;38.87,-7.01,;40.33,-7.49,;41.24,-6.25,;42.78,-6.26,;40.34,-5,;27.12,-5.45,;25.78,-6.21,;24.45,-5.43,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.20	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566984 (CHEMBL4870918) Show SMILES Fc1ccc(OCC2CCN(CC2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)c(Cl)c1 |r,wD:15.15,17.25,(22.43,-50.96,;23.77,-50.2,;25.11,-50.97,;26.44,-50.2,;26.44,-48.67,;27.77,-47.9,;29.1,-48.68,;30.44,-47.91,;30.45,-46.37,;31.78,-45.61,;33.11,-46.39,;33.12,-47.92,;31.77,-48.69,;34.44,-45.62,;34.44,-44.08,;35.77,-46.39,;36.17,-47.87,;37.65,-47.47,;37.25,-45.98,;37.64,-49.01,;39.11,-49.49,;40.02,-48.25,;41.56,-48.26,;39.12,-47,;25.11,-47.89,;25.12,-46.35,;23.77,-48.65,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	3.40	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair				3D Structure (crystal)
Monoglyceride lipase (Homo sapiens (Human))	BDBM50567002 (CHEMBL4861633) Show SMILES FC(F)(F)c1ccc(COC2CN(C2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)cc1C(F)(F)F |r,wD:16.16,18.26,(.39,-21.34,;1.72,-22.11,;1.72,-23.65,;.38,-22.87,;3.06,-21.35,;4.4,-22.12,;5.73,-21.35,;5.73,-19.82,;7.06,-19.05,;8.39,-19.83,;9.73,-19.06,;10.12,-17.58,;11.61,-17.98,;11.21,-19.47,;12.94,-17.21,;12.94,-15.67,;14.28,-17.98,;14.67,-19.46,;16.16,-19.06,;15.76,-17.58,;16.15,-20.6,;17.61,-21.09,;18.52,-19.85,;20.06,-19.85,;17.62,-18.6,;4.4,-19.04,;3.06,-19.81,;1.73,-19.03,;1.74,-17.49,;.4,-19.8,;.39,-18.25,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.80	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50567003 (CHEMBL4866307) Show SMILES FC(F)(F)c1cc(COC2CN(C2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)ccc1Cl |r,wD:15.15,17.25,(23.72,-17.25,;23.72,-18.79,;22.38,-19.56,;22.37,-18.02,;25.05,-19.57,;26.38,-18.8,;27.71,-19.58,;29.05,-18.82,;30.38,-19.59,;31.71,-18.82,;32.11,-17.34,;33.59,-17.74,;33.2,-19.23,;34.93,-16.97,;34.93,-15.43,;36.26,-17.74,;36.65,-19.22,;38.14,-18.82,;37.74,-17.34,;38.13,-20.36,;39.59,-20.85,;40.5,-19.61,;42.04,-19.61,;39.6,-18.36,;27.71,-21.11,;26.38,-21.88,;25.04,-21.11,;23.7,-21.87,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566990 (CHEMBL4871941) Show SMILES Fc1ccc(OC(C2CCN(CC2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)C(F)(F)F)c(Cl)c1 |r,wD:15.15,17.25,(64.11,-8.6,;65.45,-7.84,;66.79,-8.61,;68.12,-7.84,;68.12,-6.31,;69.45,-5.55,;70.78,-6.32,;72.12,-5.56,;72.13,-4.01,;73.46,-3.25,;74.79,-4.03,;74.8,-5.56,;73.45,-6.33,;76.12,-3.26,;76.12,-1.72,;77.45,-4.02,;77.85,-5.51,;79.33,-5.11,;78.93,-3.62,;79.32,-6.65,;80.79,-7.13,;81.7,-5.89,;83.24,-5.9,;80.8,-4.64,;70.78,-7.86,;69.44,-8.63,;72.11,-8.64,;70.77,-9.4,;66.79,-5.53,;66.8,-3.99,;65.45,-6.3,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.20	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50567000 (CHEMBL4847556) Show SMILES Clc1ccc(COC2CN(C2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)cc1Cl |r,wD:13.13,15.23,(44.07,-8.04,;45.4,-7.28,;46.74,-8.05,;48.07,-7.28,;48.07,-5.75,;49.41,-4.98,;50.74,-5.76,;52.07,-4.99,;52.47,-3.51,;53.95,-3.91,;53.56,-5.39,;55.29,-3.14,;55.29,-1.6,;56.62,-3.91,;57.01,-5.39,;58.5,-4.99,;58.1,-3.51,;58.49,-6.53,;59.95,-7.02,;60.86,-5.78,;62.4,-5.78,;59.97,-4.53,;46.74,-4.97,;45.41,-5.74,;44.08,-4.96,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.40	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566998 (CHEMBL4865443) Show SMILES FC(F)(F)c1ccc(COC2CN(C2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)c(Cl)c1 |r,wD:16.16,18.26,(.93,-8.56,;2.26,-9.33,;2.26,-10.87,;.92,-10.09,;3.59,-8.56,;4.93,-9.34,;6.27,-8.57,;6.26,-7.03,;7.6,-6.27,;8.93,-7.04,;10.27,-6.28,;10.66,-4.79,;12.15,-5.2,;11.75,-6.68,;13.48,-4.43,;13.48,-2.89,;14.82,-5.2,;15.21,-6.68,;16.69,-6.28,;16.3,-4.79,;16.68,-7.82,;18.15,-8.3,;19.06,-7.06,;20.6,-7.07,;18.16,-5.81,;4.94,-6.26,;4.94,-4.72,;3.6,-7.02,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.40	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50567005 (CHEMBL4845748) Show SMILES Cc1cc(COC2CN(C2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)ccc1C(F)(F)F |r,wD:12.12,14.22,(69.06,-16.92,;70.39,-17.7,;71.72,-16.94,;73.05,-17.71,;74.38,-16.95,;75.72,-17.72,;77.05,-16.96,;77.45,-15.47,;78.93,-15.88,;78.54,-17.36,;80.27,-15.11,;80.27,-13.57,;81.6,-15.88,;81.99,-17.36,;83.48,-16.96,;83.08,-15.47,;83.47,-18.5,;84.93,-18.98,;85.84,-17.74,;87.38,-17.75,;84.94,-16.49,;73.05,-19.25,;71.72,-20.02,;70.38,-19.24,;69.04,-20.01,;67.71,-19.23,;69.04,-21.55,;67.7,-20.77,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.40	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50567001 (CHEMBL4873898) Show SMILES Cc1ccc(COC2CN(C2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)cc1Cl |r,wD:13.13,15.23,(67.2,-7.87,;68.53,-7.11,;69.87,-7.88,;71.2,-7.11,;71.2,-5.58,;72.54,-4.81,;73.87,-5.59,;75.21,-4.82,;75.6,-3.34,;77.09,-3.74,;76.69,-5.22,;78.42,-2.97,;78.42,-1.43,;79.75,-3.74,;80.14,-5.22,;81.63,-4.82,;81.23,-3.34,;81.62,-6.36,;83.08,-6.85,;84,-5.61,;85.54,-5.61,;83.1,-4.35,;69.87,-4.8,;68.54,-5.56,;67.21,-4.79,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	6.20	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair				3D Structure (crystal)
Monoglyceride lipase (Homo sapiens (Human))	BDBM50567004 (CHEMBL4854074) Show SMILES Cc1ccc(COC2CN(C2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)cc1C(F)(F)F |r,wD:13.13,15.23,(45.27,-21.34,;46.61,-20.57,;47.95,-21.35,;49.28,-20.58,;49.28,-19.04,;50.61,-18.28,;51.94,-19.05,;53.28,-18.29,;53.68,-16.8,;55.16,-17.21,;54.76,-18.69,;56.49,-16.44,;56.49,-14.9,;57.83,-17.21,;58.22,-18.69,;59.71,-18.29,;59.31,-16.8,;59.7,-19.83,;61.16,-20.31,;62.07,-19.07,;63.61,-19.08,;61.17,-17.82,;47.95,-18.26,;46.61,-19.03,;45.28,-18.25,;45.29,-16.71,;43.95,-19.02,;43.94,-17.48,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.30	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566982 (CHEMBL4846513) Show SMILES Fc1ccc(OCC2CCN(CC2)C(=O)[C@H]2C[C@@]3(C2)CCC(=O)N3)c(Cl)c1 |r,wD:15.15,17.25,(61.37,-32.95,;62.7,-32.18,;64.04,-32.96,;65.37,-32.19,;65.37,-30.66,;66.71,-29.89,;68.04,-30.66,;69.38,-29.9,;69.38,-28.36,;70.71,-27.59,;72.04,-28.37,;72.05,-29.91,;70.71,-30.67,;73.38,-27.6,;73.38,-26.06,;74.71,-28.37,;75.1,-29.85,;76.59,-29.45,;76.19,-27.97,;76.58,-30.99,;78.04,-31.48,;78.95,-30.24,;80.49,-30.24,;78.05,-28.99,;64.04,-29.88,;64.05,-28.34,;62.71,-30.64,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566997 (CHEMBL4862009) Show SMILES Clc1ccc(COC2CN(C2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)c(Cl)c1 |r,wD:13.13,15.23,(64.82,-38.38,;66.16,-37.62,;67.5,-38.39,;68.83,-37.62,;68.83,-36.09,;70.16,-35.32,;71.49,-36.1,;72.83,-35.33,;73.22,-33.85,;74.71,-34.25,;74.31,-35.73,;76.04,-33.48,;76.04,-31.94,;77.38,-34.25,;77.77,-35.73,;79.26,-35.33,;78.86,-33.85,;79.25,-36.87,;80.71,-37.36,;81.62,-36.12,;83.16,-36.12,;80.72,-34.87,;67.5,-35.31,;67.51,-33.77,;66.16,-36.08,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50567006 (CHEMBL4856861) Show SMILES Cc1cc(COC2CN(C2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)ccc1Cl |r,wD:12.12,14.22,(2.17,-31.64,;3.5,-32.42,;4.84,-31.65,;6.16,-32.43,;7.5,-31.67,;8.83,-32.44,;10.17,-31.67,;10.56,-30.19,;12.05,-30.59,;11.65,-32.08,;13.38,-29.82,;13.38,-28.28,;14.71,-30.59,;15.11,-32.07,;16.59,-31.68,;16.19,-30.19,;16.58,-33.22,;18.05,-33.7,;18.96,-32.46,;20.5,-32.46,;18.06,-31.21,;6.16,-33.96,;4.83,-34.73,;3.49,-33.96,;2.16,-34.73,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566991 (CHEMBL4872359) Show SMILES Fc1ccc(COC2CCN(CC2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)c(Cl)c1 |r,wD:15.15,17.25,(1.98,-25.08,;3.32,-24.31,;4.66,-25.09,;5.99,-24.32,;5.99,-22.78,;7.33,-22.02,;8.66,-22.79,;9.99,-22.03,;10,-20.49,;11.33,-19.72,;12.66,-20.5,;12.67,-22.04,;11.33,-22.8,;13.99,-19.73,;13.99,-18.19,;15.33,-20.5,;15.72,-21.98,;17.21,-21.58,;16.81,-20.1,;17.2,-23.12,;18.66,-23.61,;19.57,-22.37,;21.11,-22.37,;18.67,-21.12,;4.66,-22.01,;4.67,-20.47,;3.33,-22.77,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566981 (CHEMBL4850390) Show SMILES Fc1ccc(OCC2CCN(CC2)C(=O)N2CC3(C2)CCC(=O)N3)c(Cl)c1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Mus musculus (mouse))	BDBM50567001 (CHEMBL4873898) Show SMILES Cc1ccc(COC2CN(C2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)cc1Cl |r,wD:13.13,15.23,(67.2,-7.87,;68.53,-7.11,;69.87,-7.88,;71.2,-7.11,;71.2,-5.58,;72.54,-4.81,;73.87,-5.59,;75.21,-4.82,;75.6,-3.34,;77.09,-3.74,;76.69,-5.22,;78.42,-2.97,;78.42,-1.43,;79.75,-3.74,;80.14,-5.22,;81.63,-4.82,;81.23,-3.34,;81.62,-6.36,;83.08,-6.85,;84,-5.61,;85.54,-5.61,;83.1,-4.35,;69.87,-4.8,;68.54,-5.56,;67.21,-4.79,)| Show InChI	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mouse MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Ceramide glucosyltransferase (Homo sapiens (Human))	BDBM50585896 (CHEMBL5085509) Show SMILES CC(C)(O)c1ccc(NC(=O)c2ccnn(-c3ccccc3OCC(F)(F)F)c2=O)cc1 Show InChI	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human GCS using C8-ceramide and UDP-glucose as substrate incubated for 1 hr by RapidFire mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c02078 BindingDB Entry DOI: 10.7270/Q2KW5KZB
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566972 (CHEMBL4870749) Show SMILES Fc1ccc(OCC2CCN(CC2)C(=O)c2ccc3OCC(=O)Nc3c2)c(Cl)c1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair				3D Structure (crystal)
Ceramide glucosyltransferase (Homo sapiens (Human))	BDBM50585892 (CHEMBL5092141) Show SMILES CC(C)(C#N)c1ccc(cc1)N1Cc2c(ccnc2-c2ccc(F)cc2OCC(F)(F)F)C1=O Show InChI	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human GCS using C8-ceramide and UDP-glucose as substrate incubated for 1 hr by RapidFire mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c02078 BindingDB Entry DOI: 10.7270/Q2KW5KZB
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566996 (CHEMBL4847831) Show SMILES Cc1ccc(COC2CN(C2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)c(Cl)c1 |r,wD:13.13,15.23,(42.96,-38.79,;44.3,-38.03,;45.64,-38.8,;46.97,-38.03,;46.97,-36.5,;48.3,-35.73,;49.64,-36.51,;50.97,-35.74,;51.37,-34.26,;52.85,-34.66,;52.46,-36.14,;54.19,-33.89,;54.18,-32.35,;55.52,-34.66,;55.91,-36.14,;57.4,-35.74,;57,-34.25,;57.39,-37.28,;58.85,-37.77,;59.76,-36.52,;61.3,-36.53,;58.86,-35.27,;45.64,-35.72,;45.65,-34.18,;44.3,-36.48,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Ceramide glucosyltransferase (Homo sapiens (Human))	BDBM50585900 (CHEMBL5083428) Show SMILES CC(C)(O)c1ccc(NC(=O)c2cccn(-c3ccccc3OCC(F)(F)F)c2=O)cc1 Show InChI	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human GCS using C8-ceramide and UDP-glucose as substrate incubated for 1 hr by RapidFire mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c02078 BindingDB Entry DOI: 10.7270/Q2KW5KZB
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566973 (CHEMBL4872139) Show SMILES Fc1ccc(OCC2CCN(CC2)C(=O)c2cnc3OCC(=O)Nc3c2)c(Cl)c1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566974 (CHEMBL4855733) Show SMILES Fc1ccc(OCC2CCN(CC2)C(=O)c2cc3NC(=O)COc3cn2)c(Cl)c1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566994 (CHEMBL4862447) Show SMILES Fc1ccc(OCC2CN(C2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)c(Cl)c1 |r,wD:13.13,15.23,(66.63,-25.85,;67.96,-25.08,;69.3,-25.86,;70.63,-25.09,;70.63,-23.56,;71.97,-22.79,;73.3,-23.57,;74.63,-22.8,;75.03,-21.31,;76.52,-21.72,;76.12,-23.2,;77.85,-20.95,;77.85,-19.41,;79.18,-21.72,;79.58,-23.2,;81.06,-22.8,;80.66,-21.31,;81.05,-24.34,;82.52,-24.82,;83.43,-23.58,;84.97,-23.59,;82.53,-22.33,;69.3,-22.78,;69.31,-21.24,;67.97,-23.54,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Ceramide glucosyltransferase (Homo sapiens (Human))	BDBM50585893 (CHEMBL5078078) Show SMILES CC(C)(O)c1ccc(cc1)N1Cc2c(ccnc2-c2ccc(F)cc2OCC(F)(F)F)C1=O Show InChI	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human GCS using C8-ceramide and UDP-glucose as substrate incubated for 1 hr by RapidFire mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c02078 BindingDB Entry DOI: 10.7270/Q2KW5KZB
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566975 (CHEMBL4867138) Show SMILES Fc1ccc(OCC2CCN(CC2)C(=O)c2ccc3OCC(=O)Nc3n2)c(Cl)c1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566995 (CHEMBL4870417) Show SMILES Fc1ccc(COC2CN(C2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)c(Cl)c1 |r,wD:13.13,15.23,(1.76,-39.21,;3.1,-38.44,;4.44,-39.21,;5.77,-38.44,;5.77,-36.91,;7.1,-36.15,;8.43,-36.92,;9.77,-36.16,;10.16,-34.67,;11.65,-35.07,;11.25,-36.56,;12.98,-34.3,;12.98,-32.76,;14.32,-35.07,;14.71,-36.55,;16.2,-36.15,;15.8,-34.67,;16.19,-37.7,;17.65,-38.18,;18.56,-36.94,;20.1,-36.95,;17.66,-35.69,;4.44,-36.13,;4.45,-34.59,;3.1,-36.9,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566993 (CHEMBL4874410) Show SMILES Fc1ccc(OCC2CCN(C2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)c(Cl)c1 |r,wD:14.14,16.24,(44.73,-23.76,;46.06,-22.99,;47.4,-23.76,;48.73,-22.99,;48.73,-21.46,;50.07,-20.7,;51.4,-21.47,;52.73,-20.7,;53.5,-22.04,;55.01,-21.72,;55.17,-20.18,;53.76,-19.56,;56.5,-19.41,;56.5,-17.87,;57.83,-20.18,;58.22,-21.66,;59.71,-21.26,;59.31,-19.78,;59.7,-22.8,;61.16,-23.29,;62.08,-22.05,;63.62,-22.05,;61.18,-20.8,;47.4,-20.68,;47.41,-19.14,;46.07,-21.45,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	38	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566980 (CHEMBL4867695) Show SMILES Fc1ccc(OCC2CCN(CC2)C(=O)CC[C@@H]2CCC(=O)N2)c(Cl)c1 |r| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	38	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair				3D Structure (crystal)
Ceramide glucosyltransferase (Homo sapiens (Human))	BDBM50585894 (CHEMBL5077442) Show SMILES CC(C)(O)COc1ccc(cc1)N1Cc2c(ccnc2-c2ccc(F)cc2OCC(F)(F)F)C1=O Show InChI	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human GCS using C8-ceramide and UDP-glucose as substrate incubated for 1 hr by RapidFire mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c02078 BindingDB Entry DOI: 10.7270/Q2KW5KZB
					More data for this Ligand-Target Pair
Ceramide glucosyltransferase (Homo sapiens (Human))	BDBM50585899 (CHEMBL5086168) Show SMILES CC(C)(O)c1ccc(NC(=O)c2cccc(c2F)-c2ccccc2OCC(F)(F)F)cc1 Show InChI	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human GCS using C8-ceramide and UDP-glucose as substrate incubated for 1 hr by RapidFire mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c02078 BindingDB Entry DOI: 10.7270/Q2KW5KZB
					More data for this Ligand-Target Pair
Ceramide glucosyltransferase (Homo sapiens (Human))	BDBM50585897 (CHEMBL5086523) Show SMILES CC(C)(O)c1ccc(NC(=O)c2ccnn(-c3ccc(F)cc3OCC(F)(F)F)c2=O)cc1 Show InChI	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	49	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human GCS using C8-ceramide and UDP-glucose as substrate incubated for 1 hr by RapidFire mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c02078 BindingDB Entry DOI: 10.7270/Q2KW5KZB
					More data for this Ligand-Target Pair
Ceramide glucosyltransferase (Homo sapiens (Human))	BDBM50585889 (CHEMBL5091974) Show SMILES Fc1ccc(cc1)N1Cc2c(ccnc2-c2ccc(F)cc2OC(F)(F)F)C1=O Show InChI	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	49	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human GCS using C8-ceramide and UDP-glucose as substrate incubated for 1 hr by RapidFire mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c02078 BindingDB Entry DOI: 10.7270/Q2KW5KZB
					More data for this Ligand-Target Pair
Ceramide glucosyltransferase (Mus musculus)	BDBM50585893 (CHEMBL5078078) Show SMILES CC(C)(O)c1ccc(cc1)N1Cc2c(ccnc2-c2ccc(F)cc2OCC(F)(F)F)C1=O Show InChI	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	51	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mouse GCS using C8-ceramide and UDP-glucose as substrate incubated for 1 hr by RapidFire mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c02078 BindingDB Entry DOI: 10.7270/Q2KW5KZB
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566992 (CHEMBL4854188) Show SMILES Fc1ccc(COC2CCN(C2)C(=O)[C@H]2C[C@@]3(C2)COC(=O)N3)c(Cl)c1 |r,wD:14.14,16.24,(23.31,-24.6,;24.65,-23.84,;25.99,-24.61,;27.32,-23.84,;27.32,-22.31,;28.65,-21.54,;29.98,-22.32,;31.32,-21.55,;32.09,-22.89,;33.6,-22.57,;33.75,-21.03,;32.35,-20.41,;35.09,-20.26,;35.09,-18.72,;36.42,-21.03,;36.81,-22.51,;38.3,-22.11,;37.9,-20.63,;38.29,-23.65,;39.75,-24.14,;40.66,-22.89,;42.2,-22.9,;39.76,-21.64,;25.99,-21.53,;26,-19.99,;24.65,-22.29,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	58	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566977 (CHEMBL4849041) Show SMILES Fc1ccc(OCC2CCN(CC2)C(=O)CCC2CCC(=O)N2)c(Cl)c1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair				3D Structure (crystal)
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566985 (CHEMBL4859927) Show SMILES Fc1ccc(OCC2CCN(CC2)C(=O)N2CCC3(CCC(=O)N3)C2)c(Cl)c1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	73	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Ceramide glucosyltransferase (Homo sapiens (Human))	BDBM50585886 (CHEMBL5076612) Show SMILES COc1ccccc1-c1nccc2C(=O)N(Cc12)c1ccc(C)cc1 Show InChI	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	97	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human GCS using C8-ceramide and UDP-glucose as substrate incubated for 1 hr by RapidFire mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c02078 BindingDB Entry DOI: 10.7270/Q2KW5KZB
					More data for this Ligand-Target Pair
Ceramide glucosyltransferase (Homo sapiens (Human))	BDBM50585898 (CHEMBL5091003) Show SMILES CC(C)(O)c1ccc(NC(=O)c2cccc(n2)-c2ccccc2OCC(F)(F)F)cc1 Show InChI	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human GCS using C8-ceramide and UDP-glucose as substrate incubated for 1 hr by RapidFire mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c02078 BindingDB Entry DOI: 10.7270/Q2KW5KZB
					More data for this Ligand-Target Pair
Ceramide glucosyltransferase (Mus musculus)	BDBM50585896 (CHEMBL5085509) Show SMILES CC(C)(O)c1ccc(NC(=O)c2ccnn(-c3ccccc3OCC(F)(F)F)c2=O)cc1 Show InChI	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mouse GCS using C8-ceramide and UDP-glucose as substrate incubated for 1 hr by RapidFire mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c02078 BindingDB Entry DOI: 10.7270/Q2KW5KZB
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566978 (CHEMBL4870350) Show SMILES Fc1ccc(OCC2CCN(CC2)C(=O)OCC2CCC(=O)N2)c(Cl)c1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50585893 (CHEMBL5078078) Show SMILES CC(C)(O)c1ccc(cc1)N1Cc2c(ccnc2-c2ccc(F)cc2OCC(F)(F)F)C1=O Show InChI	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human SERT				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c02078 BindingDB Entry DOI: 10.7270/Q2KW5KZB
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566979 (CHEMBL4876184) Show SMILES Fc1ccc(OCC2CCN(CC2)C(=O)CC[C@H]2CCC(=O)N2)c(Cl)c1 |r| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	590	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Ceramide glucosyltransferase (Homo sapiens (Human))	BDBM50585891 (CHEMBL5089984) Show SMILES CS(=O)(=O)c1ccc(cc1)N1Cc2c(ccnc2-c2ccc(F)cc2OCC(F)(F)F)C1=O Show InChI	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	630	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human GCS using C8-ceramide and UDP-glucose as substrate incubated for 1 hr by RapidFire mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c02078 BindingDB Entry DOI: 10.7270/Q2KW5KZB
					More data for this Ligand-Target Pair
Ceramide glucosyltransferase (Homo sapiens (Human))	BDBM50585890 (CHEMBL5081829) Show SMILES CN(C)C(=O)c1ccc(cc1)N1Cc2c(ccnc2-c2ccc(F)cc2OCC(F)(F)F)C1=O Show InChI	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human GCS using C8-ceramide and UDP-glucose as substrate incubated for 1 hr by RapidFire mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c02078 BindingDB Entry DOI: 10.7270/Q2KW5KZB
					More data for this Ligand-Target Pair
Monoglyceride lipase (Homo sapiens (Human))	BDBM50566983 (CHEMBL4864582) Show SMILES Fc1ccc(OCC2CCN(CC2)C(=O)[C@H]2C[C@]3(C2)CCC(=O)N3)c(Cl)c1 |r,wU:17.25,wD:15.15,(.8,-50.56,;2.14,-49.79,;3.48,-50.57,;4.81,-49.8,;4.81,-48.26,;6.14,-47.5,;7.47,-48.27,;8.81,-47.51,;8.82,-45.97,;10.15,-45.2,;11.48,-45.98,;11.49,-47.52,;10.14,-48.28,;12.81,-45.21,;12.81,-43.67,;14.15,-45.98,;14.54,-47.46,;16.02,-47.06,;15.62,-45.58,;16.01,-48.6,;17.48,-49.09,;18.39,-47.85,;19.93,-47.85,;17.49,-46.6,;3.48,-47.49,;3.49,-45.95,;2.14,-48.25,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	890	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human His-tagged MAGL assessed as formation of arachidonic acid using 2-acylglycerol incubated for 10 mins by mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00432 BindingDB Entry DOI: 10.7270/Q2M90DDN
					More data for this Ligand-Target Pair
Ceramide glucosyltransferase (Homo sapiens (Human))	BDBM50585887 (CHEMBL5088946) Show SMILES COc1ccccc1-c1nccc2C(=O)N(Cc12)c1ccc(F)cc1 Show InChI	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human GCS using C8-ceramide and UDP-glucose as substrate incubated for 1 hr by RapidFire mass spectrometry				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c02078 BindingDB Entry DOI: 10.7270/Q2KW5KZB
					More data for this Ligand-Target Pair

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