Compile Data Set for Download or QSAR

Found 48 hits with Last Name = 'gallienne' and Initial = 'e'   

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
Lysosomal acid glucosylceramidase (Homo sapiens (Human))	BDBM50315250 ((2R,3S,4S,5R)-2-nonylpiperidine-3,4,5-triol | CHEM...) Show SMILES CCCCCCCCC[C@H]1NC[C@@H](O)[C@H](O)[C@H]1O |r| Show InChI InChI=1S/C14H29NO3/c1-2-3-4-5-6-7-8-9-11-13(17)14(18)12(16)10-15-11/h11-18H,2-10H2,1H3/t11-,12-,13+,14+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans& CNRS Curated by ChEMBL					Assay Description Inhibition of human recombinant beta-glucocerebrosidase assessed as p-nitrophenolate accumulation preincubated for 10 mins before p-nitrophenyl-beta-...				Bioorg Med Chem 18: 2645-50 (2010) Article DOI: 10.1016/j.bmc.2010.02.027 BindingDB Entry DOI: 10.7270/Q24F1QVM
					More data for this Ligand-Target Pair
Beta-galactosidase (Homo sapiens (Human))	BDBM50469238 (CHEMBL4288931) Show SMILES CCCCCCCCC[C@H]1NC[C@@H](O)[C@@H](O)[C@H]1CO |r| Show InChI InChI=1S/C15H31NO3/c1-2-3-4-5-6-7-8-9-13-12(11-17)15(19)14(18)10-16-13/h12-19H,2-11H2,1H3/t12-,13+,14+,15-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.400	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans & CNRS Curated by ChEMBL					Assay Description Inhibition of beta-galactosidase derived from human peripheral blood mononuclear cell lysate using 4-methylumbelliferyl beta-D-galactopyranoside as s...				Bioorg Med Chem 26: 5462-5469 (2018) Article DOI: 10.1016/j.bmc.2018.09.023 BindingDB Entry DOI: 10.7270/Q2G73HFJ
					More data for this Ligand-Target Pair
Beta-galactosidase (Homo sapiens (Human))	BDBM50235812 (CHEMBL4085739) Show SMILES CCCCC[C@H]1NC[C@@H](O)[C@@H](O)[C@H]1CO |r| Show InChI InChI=1S/C11H23NO3/c1-2-3-4-5-9-8(7-13)11(15)10(14)6-12-9/h8-15H,2-7H2,1H3/t8-,9+,10+,11-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans& CNRS Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Eur J Med Chem 126: 160-170 (2017) Article DOI: 10.1016/j.ejmech.2016.09.095 BindingDB Entry DOI: 10.7270/Q21G0PHR
					More data for this Ligand-Target Pair
Beta-galactosidase (Homo sapiens (Human))	BDBM50469239 (CHEMBL4284436) Show SMILES OC[C@@H]1[C@H](O)[C@H](O)CN[C@@H]1CCc1ccccc1 |r| Show InChI InChI=1S/C14H21NO3/c16-9-11-12(15-8-13(17)14(11)18)7-6-10-4-2-1-3-5-10/h1-5,11-18H,6-9H2/t11-,12+,13+,14-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans & CNRS Curated by ChEMBL					Assay Description Inhibition of beta-galactosidase derived from human peripheral blood mononuclear cell lysate using 4-methylumbelliferyl beta-D-galactopyranoside as s...				Bioorg Med Chem 26: 5462-5469 (2018) Article DOI: 10.1016/j.bmc.2018.09.023 BindingDB Entry DOI: 10.7270/Q2G73HFJ
					More data for this Ligand-Target Pair
Beta-galactosidase (Homo sapiens (Human))	BDBM50235812 (CHEMBL4085739) Show SMILES CCCCC[C@H]1NC[C@@H](O)[C@@H](O)[C@H]1CO |r| Show InChI InChI=1S/C11H23NO3/c1-2-3-4-5-9-8(7-13)11(15)10(14)6-12-9/h8-15H,2-7H2,1H3/t8-,9+,10+,11-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans & CNRS Curated by ChEMBL					Assay Description Inhibition of beta-galactosidase derived from human peripheral blood mononuclear cell lysate using 4-methylumbelliferyl beta-D-galactopyranoside as s...				Bioorg Med Chem 26: 5462-5469 (2018) Article DOI: 10.1016/j.bmc.2018.09.023 BindingDB Entry DOI: 10.7270/Q2G73HFJ
					More data for this Ligand-Target Pair
Lysosomal acid glucosylceramidase (Homo sapiens (Human))	BDBM50315255 ((2R,3S,4S,5R)-2-hexylpiperidine-3,4,5-triol | CHEM...) Show SMILES CCCCCC[C@H]1NC[C@@H](O)[C@H](O)[C@H]1O |r| Show InChI InChI=1S/C11H23NO3/c1-2-3-4-5-6-8-10(14)11(15)9(13)7-12-8/h8-15H,2-7H2,1H3/t8-,9-,10+,11+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans& CNRS Curated by ChEMBL					Assay Description Inhibition of human recombinant beta-glucocerebrosidase assessed as p-nitrophenolate accumulation preincubated for 10 mins before p-nitrophenyl-beta-...				Bioorg Med Chem 18: 2645-50 (2010) Article DOI: 10.1016/j.bmc.2010.02.027 BindingDB Entry DOI: 10.7270/Q24F1QVM
					More data for this Ligand-Target Pair
Non-lysosomal glucosylceramidase (Homo sapiens (Human))	BDBM50182801 ((3R,4R,5R)-5-(Hydroxymethyl)piperidine-3,4-diol, 8...) Show SMILES OC[C@H]1CNC[C@@H](O)[C@@H]1O |r| Show InChI InChI=1S/C6H13NO3/c8-3-4-1-7-2-5(9)6(4)10/h4-10H,1-3H2/t4-,5-,6-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans & CNRS Curated by ChEMBL					Assay Description Inhibition of beta-glucosidase derived from human peripheral blood mononuclear cell lysate using 4-methylumbelliferyl beta-D-glucopyranoside as subst...				Bioorg Med Chem 26: 5462-5469 (2018) Article DOI: 10.1016/j.bmc.2018.09.023 BindingDB Entry DOI: 10.7270/Q2G73HFJ
					More data for this Ligand-Target Pair
Non-lysosomal glucosylceramidase (Homo sapiens (Human))	BDBM50469238 (CHEMBL4288931) Show SMILES CCCCCCCCC[C@H]1NC[C@@H](O)[C@@H](O)[C@H]1CO |r| Show InChI InChI=1S/C15H31NO3/c1-2-3-4-5-6-7-8-9-13-12(11-17)15(19)14(18)10-16-13/h12-19H,2-11H2,1H3/t12-,13+,14+,15-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt 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
Universit£ d'Orl£ans & CNRS Curated by ChEMBL					Assay Description Inhibition of beta-glucosidase derived from human peripheral blood mononuclear cell lysate using 4-methylumbelliferyl beta-D-glucopyranoside as subst...				Bioorg Med Chem 26: 5462-5469 (2018) Article DOI: 10.1016/j.bmc.2018.09.023 BindingDB Entry DOI: 10.7270/Q2G73HFJ
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM8961 (1,2,3,4-tetrahydro-9-acridinamine | 1,2,3,4-tetrah...) Show SMILES Nc1c2CCCCc2nc2ccccc12 Show InChI InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	73	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Strasbourg/CNRS (UMR 7509) Curated by ChEMBL					Assay Description Inhibition of human recombinant serum BuchE using butyrylthiocholine iodide as substrate by Ellman method				Bioorg Med Chem Lett 25: 830-3 (2015) Article DOI: 10.1016/j.bmcl.2014.12.071 BindingDB Entry DOI: 10.7270/Q22B90QH
					More data for this Ligand-Target Pair				3D Structure (crystal)
Beta-hexosaminidase subunit alpha (Homo sapiens (Human))	BDBM50235813 (CHEMBL4097052) Show SMILES CC(=O)N[C@H]1[C@@H](COCCCCc2ccccc2)N[C@H](CO)[C@@H](O)[C@@H]1O |r| Show InChI InChI=1S/C19H30N2O5/c1-13(23)20-17-16(21-15(11-22)18(24)19(17)25)12-26-10-6-5-9-14-7-3-2-4-8-14/h2-4,7-8,15-19,21-22,24-25H,5-6,9-12H2,1H3,(H,20,23)/t15-,16-,17+,18-,19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans& CNRS Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Eur J Med Chem 126: 160-170 (2017) Article DOI: 10.1016/j.ejmech.2016.09.095 BindingDB Entry DOI: 10.7270/Q21G0PHR
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM8961 (1,2,3,4-tetrahydro-9-acridinamine | 1,2,3,4-tetrah...) Show SMILES Nc1c2CCCCc2nc2ccccc12 Show InChI InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15)	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	136	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Strasbourg/CNRS (UMR 7509) Curated by ChEMBL					Assay Description Inhibition of electric eel AchE using acetylthiocholine iodide as substrate by Ellman method				Bioorg Med Chem Lett 25: 830-3 (2015) Article DOI: 10.1016/j.bmcl.2014.12.071 BindingDB Entry DOI: 10.7270/Q22B90QH
					More data for this Ligand-Target Pair
Beta-galactosidase (Homo sapiens (Human))	BDBM50235812 (CHEMBL4085739) Show SMILES CCCCC[C@H]1NC[C@@H](O)[C@@H](O)[C@H]1CO |r| Show InChI InChI=1S/C11H23NO3/c1-2-3-4-5-9-8(7-13)11(15)10(14)6-12-9/h8-15H,2-7H2,1H3/t8-,9+,10+,11-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans& CNRS Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Eur J Med Chem 126: 160-170 (2017) Article DOI: 10.1016/j.ejmech.2016.09.095 BindingDB Entry DOI: 10.7270/Q21G0PHR
					More data for this Ligand-Target Pair
Beta-galactosidase (Homo sapiens (Human))	BDBM50350758 (CHEMBL1818433) Show SMILES OC[C@H]1CNC[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C6H13NO3/c8-3-4-1-7-2-5(9)6(4)10/h4-10H,1-3H2/t4-,5-,6+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	240	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans& CNRS Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Eur J Med Chem 126: 160-170 (2017) Article DOI: 10.1016/j.ejmech.2016.09.095 BindingDB Entry DOI: 10.7270/Q21G0PHR
					More data for this Ligand-Target Pair
Beta-galactosidase (Homo sapiens (Human))	BDBM50469237 (CHEMBL4281031) Show SMILES C[C@H]1NC[C@@H](O)[C@@H](O)[C@H]1CO |r| Show InChI InChI=1S/C7H15NO3/c1-4-5(3-9)7(11)6(10)2-8-4/h4-11H,2-3H2,1H3/t4-,5+,6-,7+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans & CNRS Curated by ChEMBL					Assay Description Inhibition of beta-galactosidase derived from human peripheral blood mononuclear cell lysate using 4-methylumbelliferyl beta-D-galactopyranoside as s...				Bioorg Med Chem 26: 5462-5469 (2018) Article DOI: 10.1016/j.bmc.2018.09.023 BindingDB Entry DOI: 10.7270/Q2G73HFJ
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM8961 (1,2,3,4-tetrahydro-9-acridinamine | 1,2,3,4-tetrah...) Show SMILES Nc1c2CCCCc2nc2ccccc12 Show InChI InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	484	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Strasbourg/CNRS (UMR 7509) Curated by ChEMBL					Assay Description Inhibition of human recombinant AchE using acetylthiocholine iodide as substrate by Ellman method				Bioorg Med Chem Lett 25: 830-3 (2015) Article DOI: 10.1016/j.bmcl.2014.12.071 BindingDB Entry DOI: 10.7270/Q22B90QH
					More data for this Ligand-Target Pair				3D Structure (crystal)
Lysosomal acid glucosylceramidase (Homo sapiens (Human))	BDBM50315252 ((2R,3S,4S,5R)-2-propylpiperidine-3,4,5-triol | CHE...) Show SMILES CCC[C@H]1NC[C@@H](O)[C@H](O)[C@H]1O |r| Show InChI InChI=1S/C8H17NO3/c1-2-3-5-7(11)8(12)6(10)4-9-5/h5-12H,2-4H2,1H3/t5-,6-,7+,8+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	560	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans& CNRS Curated by ChEMBL					Assay Description Inhibition of human recombinant beta-glucocerebrosidase assessed as p-nitrophenolate accumulation preincubated for 10 mins before p-nitrophenyl-beta-...				Bioorg Med Chem 18: 2645-50 (2010) Article DOI: 10.1016/j.bmc.2010.02.027 BindingDB Entry DOI: 10.7270/Q24F1QVM
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50061158 (CHEMBL3393676) Show SMILES O[C@@H]1CN[C@H](Cc2cn(Cc3cc(OCc4ccccc4)cc(OCc4ccccc4)c3)nn2)[C@H](O)[C@H]1O |r| Show InChI InChI=1S/C29H32N4O5/c34-27-15-30-26(28(35)29(27)36)13-23-17-33(32-31-23)16-22-11-24(37-18-20-7-3-1-4-8-20)14-25(12-22)38-19-21-9-5-2-6-10-21/h1-12,14,17,26-30,34-36H,13,15-16,18-19H2/t26-,27-,28+,29+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Strasbourg/CNRS (UMR 7509) Curated by ChEMBL					Assay Description Inhibition of human recombinant serum BuchE using butyrylthiocholine iodide as substrate by Ellman method				Bioorg Med Chem Lett 25: 830-3 (2015) Article DOI: 10.1016/j.bmcl.2014.12.071 BindingDB Entry DOI: 10.7270/Q22B90QH
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50061159 (CHEMBL3393675) Show SMILES O=C1N[C@H](COCc2ccccc2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1 |r| Show InChI InChI=1S/C34H35NO5/c36-34-33(40-24-29-19-11-4-12-20-29)32(39-23-28-17-9-3-10-18-28)31(38-22-27-15-7-2-8-16-27)30(35-34)25-37-21-26-13-5-1-6-14-26/h1-20,30-33H,21-25H2,(H,35,36)/t30-,31-,32+,33-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Strasbourg/CNRS (UMR 7509) Curated by ChEMBL					Assay Description Inhibition of electric eel AchE using acetylthiocholine iodide as substrate by Ellman method				Bioorg Med Chem Lett 25: 830-3 (2015) Article DOI: 10.1016/j.bmcl.2014.12.071 BindingDB Entry DOI: 10.7270/Q22B90QH
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50061161 (CHEMBL3393673) Show SMILES C(OCc1ccccc1)[C@H]1NC[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 |r| Show InChI InChI=1S/C34H37NO4/c1-5-13-27(14-6-1)22-36-26-31-33(38-24-29-17-9-3-10-18-29)34(39-25-30-19-11-4-12-20-30)32(21-35-31)37-23-28-15-7-2-8-16-28/h1-20,31-35H,21-26H2/t31-,32+,33-,34-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Strasbourg/CNRS (UMR 7509) Curated by ChEMBL					Assay Description Inhibition of human recombinant serum BuchE using butyrylthiocholine iodide as substrate by Ellman method				Bioorg Med Chem Lett 25: 830-3 (2015) Article DOI: 10.1016/j.bmcl.2014.12.071 BindingDB Entry DOI: 10.7270/Q22B90QH
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50061160 (CHEMBL3393674) Show SMILES CCCCCCCCN1C[C@@H](O)[C@H](OCc2ccccc2)[C@@H](O)[C@H]1CC=C |r| Show InChI InChI=1S/C23H37NO3/c1-3-5-6-7-8-12-16-24-17-21(25)23(22(26)20(24)13-4-2)27-18-19-14-10-9-11-15-19/h4,9-11,14-15,20-23,25-26H,2-3,5-8,12-13,16-18H2,1H3/t20-,21-,22+,23+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Strasbourg/CNRS (UMR 7509) Curated by ChEMBL					Assay Description Inhibition of human recombinant serum BuchE using butyrylthiocholine iodide as substrate by Ellman method				Bioorg Med Chem Lett 25: 830-3 (2015) Article DOI: 10.1016/j.bmcl.2014.12.071 BindingDB Entry DOI: 10.7270/Q22B90QH
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50061161 (CHEMBL3393673) Show SMILES C(OCc1ccccc1)[C@H]1NC[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 |r| Show InChI InChI=1S/C34H37NO4/c1-5-13-27(14-6-1)22-36-26-31-33(38-24-29-17-9-3-10-18-29)34(39-25-30-19-11-4-12-20-30)32(21-35-31)37-23-28-15-7-2-8-16-28/h1-20,31-35H,21-26H2/t31-,32+,33-,34-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Strasbourg/CNRS (UMR 7509) Curated by ChEMBL					Assay Description Inhibition of electric eel AchE using acetylthiocholine iodide as substrate by Ellman method				Bioorg Med Chem Lett 25: 830-3 (2015) Article DOI: 10.1016/j.bmcl.2014.12.071 BindingDB Entry DOI: 10.7270/Q22B90QH
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50061159 (CHEMBL3393675) Show SMILES O=C1N[C@H](COCc2ccccc2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1 |r| Show InChI InChI=1S/C34H35NO5/c36-34-33(40-24-29-19-11-4-12-20-29)32(39-23-28-17-9-3-10-18-28)31(38-22-27-15-7-2-8-16-27)30(35-34)25-37-21-26-13-5-1-6-14-26/h1-20,30-33H,21-25H2,(H,35,36)/t30-,31-,32+,33-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Strasbourg/CNRS (UMR 7509) Curated by ChEMBL					Assay Description Inhibition of human recombinant serum BuchE using butyrylthiocholine iodide as substrate by Ellman method				Bioorg Med Chem Lett 25: 830-3 (2015) Article DOI: 10.1016/j.bmcl.2014.12.071 BindingDB Entry DOI: 10.7270/Q22B90QH
					More data for this Ligand-Target Pair
Lysosomal acid glucosylceramidase (Homo sapiens (Human))	BDBM18362 ((2R,3S,4R,5R,6R)-2-hexyl-6-(hydroxymethyl)piperidi...) Show SMILES CCCCCC[C@H]1N[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O Show InChI InChI=1S/C12H25NO4/c1-2-3-4-5-6-8-10(15)12(17)11(16)9(7-14)13-8/h8-17H,2-7H2,1H3/t8-,9-,10+,11-,12-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans& CNRS Curated by ChEMBL					Assay Description Inhibition of human recombinant beta-glucocerebrosidase preincubated for 10 mins before 4-methylumbelliferyl-betaD-glucopyranoside addition measured ...				Bioorg Med Chem 18: 2645-50 (2010) Article DOI: 10.1016/j.bmc.2010.02.027 BindingDB Entry DOI: 10.7270/Q24F1QVM
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50061157 (CHEMBL3393677) Show SMILES O[C@@H]1CN[C@H](Cc2cn(Cc3ccccc3)nn2)[C@H](OCc2ccccc2)[C@H]1O |r| Show InChI InChI=1S/C22H26N4O3/c27-20-12-23-19(22(21(20)28)29-15-17-9-5-2-6-10-17)11-18-14-26(25-24-18)13-16-7-3-1-4-8-16/h1-10,14,19-23,27-28H,11-13,15H2/t19-,20-,21+,22+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Strasbourg/CNRS (UMR 7509) Curated by ChEMBL					Assay Description Inhibition of human recombinant serum BuchE using butyrylthiocholine iodide as substrate by Ellman method				Bioorg Med Chem Lett 25: 830-3 (2015) Article DOI: 10.1016/j.bmcl.2014.12.071 BindingDB Entry DOI: 10.7270/Q22B90QH
					More data for this Ligand-Target Pair
Non-lysosomal glucosylceramidase (Homo sapiens (Human))	BDBM50235812 (CHEMBL4085739) Show SMILES CCCCC[C@H]1NC[C@@H](O)[C@@H](O)[C@H]1CO |r| Show InChI InChI=1S/C11H23NO3/c1-2-3-4-5-9-8(7-13)11(15)10(14)6-12-9/h8-15H,2-7H2,1H3/t8-,9+,10+,11-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans & CNRS Curated by ChEMBL					Assay Description Inhibition of beta-glucosidase derived from human peripheral blood mononuclear cell lysate using 4-methylumbelliferyl beta-D-glucopyranoside as subst...				Bioorg Med Chem 26: 5462-5469 (2018) Article DOI: 10.1016/j.bmc.2018.09.023 BindingDB Entry DOI: 10.7270/Q2G73HFJ
					More data for this Ligand-Target Pair
Non-lysosomal glucosylceramidase (Homo sapiens (Human))	BDBM50469239 (CHEMBL4284436) Show SMILES OC[C@@H]1[C@H](O)[C@H](O)CN[C@@H]1CCc1ccccc1 |r| Show InChI InChI=1S/C14H21NO3/c16-9-11-12(15-8-13(17)14(11)18)7-6-10-4-2-1-3-5-10/h1-5,11-18H,6-9H2/t11-,12+,13+,14-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans & CNRS Curated by ChEMBL					Assay Description Inhibition of beta-glucosidase derived from human peripheral blood mononuclear cell lysate using 4-methylumbelliferyl beta-D-glucopyranoside as subst...				Bioorg Med Chem 26: 5462-5469 (2018) Article DOI: 10.1016/j.bmc.2018.09.023 BindingDB Entry DOI: 10.7270/Q2G73HFJ
					More data for this Ligand-Target Pair
Non-lysosomal glucosylceramidase (Homo sapiens (Human))	BDBM50469237 (CHEMBL4281031) Show SMILES C[C@H]1NC[C@@H](O)[C@@H](O)[C@H]1CO |r| Show InChI InChI=1S/C7H15NO3/c1-4-5(3-9)7(11)6(10)2-8-4/h4-11H,2-3H2,1H3/t4-,5+,6-,7+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans & CNRS Curated by ChEMBL					Assay Description Inhibition of beta-glucosidase derived from human peripheral blood mononuclear cell lysate using 4-methylumbelliferyl beta-D-glucopyranoside as subst...				Bioorg Med Chem 26: 5462-5469 (2018) Article DOI: 10.1016/j.bmc.2018.09.023 BindingDB Entry DOI: 10.7270/Q2G73HFJ
					More data for this Ligand-Target Pair
Beta-galactosidase (Homo sapiens (Human))	BDBM50182801 ((3R,4R,5R)-5-(Hydroxymethyl)piperidine-3,4-diol, 8...) Show SMILES OC[C@H]1CNC[C@@H](O)[C@@H]1O |r| Show InChI InChI=1S/C6H13NO3/c8-3-4-1-7-2-5(9)6(4)10/h4-10H,1-3H2/t4-,5-,6-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans & CNRS Curated by ChEMBL					Assay Description Inhibition of beta-galactosidase derived from human peripheral blood mononuclear cell lysate using 4-methylumbelliferyl beta-D-galactopyranoside as s...				Bioorg Med Chem 26: 5462-5469 (2018) Article DOI: 10.1016/j.bmc.2018.09.023 BindingDB Entry DOI: 10.7270/Q2G73HFJ
					More data for this Ligand-Target Pair
Beta-galactosidase (Homo sapiens (Human))	BDBM50350758 (CHEMBL1818433) Show SMILES OC[C@H]1CNC[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C6H13NO3/c8-3-4-1-7-2-5(9)6(4)10/h4-10H,1-3H2/t4-,5-,6+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans& CNRS Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Eur J Med Chem 126: 160-170 (2017) Article DOI: 10.1016/j.ejmech.2016.09.095 BindingDB Entry DOI: 10.7270/Q21G0PHR
					More data for this Ligand-Target Pair
Beta-galactosidase (Homo sapiens (Human))	BDBM50235815 (CHEMBL4099495) Show SMILES CCCCC[C@@H]1NC[C@@H](O)[C@@H](O)[C@H]1CO |r| Show InChI InChI=1S/C11H23NO3/c1-2-3-4-5-9-8(7-13)11(15)10(14)6-12-9/h8-15H,2-7H2,1H3/t8-,9-,10+,11-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans& CNRS Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Eur J Med Chem 126: 160-170 (2017) Article DOI: 10.1016/j.ejmech.2016.09.095 BindingDB Entry DOI: 10.7270/Q21G0PHR
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50061152 (CHEMBL3393678) Show SMILES O[C@@H]1CN[C@H](Cc2cn(CCC(c3ccccc3)c3ccccc3)nn2)[C@H](O)[C@H]1O |r| Show InChI InChI=1S/C23H28N4O3/c28-21-14-24-20(22(29)23(21)30)13-18-15-27(26-25-18)12-11-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,15,19-24,28-30H,11-14H2/t20-,21-,22+,23+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Strasbourg/CNRS (UMR 7509) Curated by ChEMBL					Assay Description Inhibition of human recombinant serum BuchE using butyrylthiocholine iodide as substrate by Ellman method				Bioorg Med Chem Lett 25: 830-3 (2015) Article DOI: 10.1016/j.bmcl.2014.12.071 BindingDB Entry DOI: 10.7270/Q22B90QH
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50061160 (CHEMBL3393674) Show SMILES CCCCCCCCN1C[C@@H](O)[C@H](OCc2ccccc2)[C@@H](O)[C@H]1CC=C |r| Show InChI InChI=1S/C23H37NO3/c1-3-5-6-7-8-12-16-24-17-21(25)23(22(26)20(24)13-4-2)27-18-19-14-10-9-11-15-19/h4,9-11,14-15,20-23,25-26H,2-3,5-8,12-13,16-18H2,1H3/t20-,21-,22+,23+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Strasbourg/CNRS (UMR 7509) Curated by ChEMBL					Assay Description Inhibition of human recombinant AchE using acetylthiocholine iodide as substrate by Ellman method				Bioorg Med Chem Lett 25: 830-3 (2015) Article DOI: 10.1016/j.bmcl.2014.12.071 BindingDB Entry DOI: 10.7270/Q22B90QH
					More data for this Ligand-Target Pair
Lysosomal acid glucosylceramidase (Homo sapiens (Human))	BDBM50315254 ((2R,3S,4R,5R,6S)-2-hexyl-6-(hydroxymethyl)piperidi...) Show SMILES CCCCCC[C@H]1N[C@@H](CO)[C@@H](O)[C@H](O)[C@H]1O |r| Show InChI InChI=1S/C12H25NO4/c1-2-3-4-5-6-8-10(15)12(17)11(16)9(7-14)13-8/h8-17H,2-7H2,1H3/t8-,9+,10+,11-,12-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans& CNRS Curated by ChEMBL					Assay Description Inhibition of human recombinant beta-glucocerebrosidase assessed as p-nitrophenolate accumulation preincubated for 10 mins before p-nitrophenyl-beta-...				Bioorg Med Chem 18: 2645-50 (2010) Article DOI: 10.1016/j.bmc.2010.02.027 BindingDB Entry DOI: 10.7270/Q24F1QVM
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50061159 (CHEMBL3393675) Show SMILES O=C1N[C@H](COCc2ccccc2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1 |r| Show InChI InChI=1S/C34H35NO5/c36-34-33(40-24-29-19-11-4-12-20-29)32(39-23-28-17-9-3-10-18-28)31(38-22-27-15-7-2-8-16-27)30(35-34)25-37-21-26-13-5-1-6-14-26/h1-20,30-33H,21-25H2,(H,35,36)/t30-,31-,32+,33-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Strasbourg/CNRS (UMR 7509) Curated by ChEMBL					Assay Description Inhibition of human recombinant AchE using acetylthiocholine iodide as substrate by Ellman method				Bioorg Med Chem Lett 25: 830-3 (2015) Article DOI: 10.1016/j.bmcl.2014.12.071 BindingDB Entry DOI: 10.7270/Q22B90QH
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50061161 (CHEMBL3393673) Show SMILES C(OCc1ccccc1)[C@H]1NC[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 |r| Show InChI InChI=1S/C34H37NO4/c1-5-13-27(14-6-1)22-36-26-31-33(38-24-29-17-9-3-10-18-29)34(39-25-30-19-11-4-12-20-30)32(21-35-31)37-23-28-15-7-2-8-16-28/h1-20,31-35H,21-26H2/t31-,32+,33-,34-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Strasbourg/CNRS (UMR 7509) Curated by ChEMBL					Assay Description Inhibition of human recombinant AchE using acetylthiocholine iodide as substrate by Ellman method				Bioorg Med Chem Lett 25: 830-3 (2015) Article DOI: 10.1016/j.bmcl.2014.12.071 BindingDB Entry DOI: 10.7270/Q22B90QH
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50061151 (CHEMBL3393679) Show SMILES O[C@@H]1CN[C@H](CC=C)[C@H](O)[C@H]1OCc1ccccc1 |r| Show InChI InChI=1S/C15H21NO3/c1-2-6-12-14(18)15(13(17)9-16-12)19-10-11-7-4-3-5-8-11/h2-5,7-8,12-18H,1,6,9-10H2/t12-,13-,14+,15+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Strasbourg/CNRS (UMR 7509) Curated by ChEMBL					Assay Description Inhibition of human recombinant serum BuchE using butyrylthiocholine iodide as substrate by Ellman method				Bioorg Med Chem Lett 25: 830-3 (2015) Article DOI: 10.1016/j.bmcl.2014.12.071 BindingDB Entry DOI: 10.7270/Q22B90QH
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50061160 (CHEMBL3393674) Show SMILES CCCCCCCCN1C[C@@H](O)[C@H](OCc2ccccc2)[C@@H](O)[C@H]1CC=C |r| Show InChI InChI=1S/C23H37NO3/c1-3-5-6-7-8-12-16-24-17-21(25)23(22(26)20(24)13-4-2)27-18-19-14-10-9-11-15-19/h4,9-11,14-15,20-23,25-26H,2-3,5-8,12-13,16-18H2,1H3/t20-,21-,22+,23+/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Strasbourg/CNRS (UMR 7509) Curated by ChEMBL					Assay Description Inhibition of electric eel AchE using acetylthiocholine iodide as substrate by Ellman method				Bioorg Med Chem Lett 25: 830-3 (2015) Article DOI: 10.1016/j.bmcl.2014.12.071 BindingDB Entry DOI: 10.7270/Q22B90QH
					More data for this Ligand-Target Pair
Probable maltase-glucoamylase 2 (Homo sapiens)	BDBM50469237 (CHEMBL4281031) Show SMILES C[C@H]1NC[C@@H](O)[C@@H](O)[C@H]1CO |r| Show InChI InChI=1S/C7H15NO3/c1-4-5(3-9)7(11)6(10)2-8-4/h4-11H,2-3H2,1H3/t4-,5+,6-,7+/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans & CNRS Curated by ChEMBL					Assay Description Inhibition of alpha-glucosidase derived from human peripheral blood mononuclear cell lysate using 4-methylumbelliferyl alpha-D-glucopyranoside as sub...				Bioorg Med Chem 26: 5462-5469 (2018) Article DOI: 10.1016/j.bmc.2018.09.023 BindingDB Entry DOI: 10.7270/Q2G73HFJ
					More data for this Ligand-Target Pair
Probable maltase-glucoamylase 2 (Homo sapiens)	BDBM50235812 (CHEMBL4085739) Show SMILES CCCCC[C@H]1NC[C@@H](O)[C@@H](O)[C@H]1CO |r| Show InChI InChI=1S/C11H23NO3/c1-2-3-4-5-9-8(7-13)11(15)10(14)6-12-9/h8-15H,2-7H2,1H3/t8-,9+,10+,11-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans & CNRS Curated by ChEMBL					Assay Description Inhibition of alpha-glucosidase derived from human peripheral blood mononuclear cell lysate using 4-methylumbelliferyl alpha-D-glucopyranoside as sub...				Bioorg Med Chem 26: 5462-5469 (2018) Article DOI: 10.1016/j.bmc.2018.09.023 BindingDB Entry DOI: 10.7270/Q2G73HFJ
					More data for this Ligand-Target Pair
Probable maltase-glucoamylase 2 (Homo sapiens)	BDBM50469238 (CHEMBL4288931) Show SMILES CCCCCCCCC[C@H]1NC[C@@H](O)[C@@H](O)[C@H]1CO |r| Show InChI InChI=1S/C15H31NO3/c1-2-3-4-5-6-7-8-9-13-12(11-17)15(19)14(18)10-16-13/h12-19H,2-11H2,1H3/t12-,13+,14+,15-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans & CNRS Curated by ChEMBL					Assay Description Inhibition of alpha-glucosidase derived from human peripheral blood mononuclear cell lysate using 4-methylumbelliferyl alpha-D-glucopyranoside as sub...				Bioorg Med Chem 26: 5462-5469 (2018) Article DOI: 10.1016/j.bmc.2018.09.023 BindingDB Entry DOI: 10.7270/Q2G73HFJ
					More data for this Ligand-Target Pair
Lysosomal acid glucosylceramidase (Homo sapiens (Human))	BDBM18361 ((2R,3S,4R,5R,6R)-2-butyl-6-(hydroxymethyl)piperidi...) Show SMILES CCCC[C@H]1N[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O Show InChI InChI=1S/C10H21NO4/c1-2-3-4-6-8(13)10(15)9(14)7(5-12)11-6/h6-15H,2-5H2,1H3/t6-,7-,8+,9-,10-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans& CNRS Curated by ChEMBL					Assay Description Inhibition of human recombinant beta-glucocerebrosidase preincubated for 10 mins before 4-methylumbelliferyl-betaD-glucopyranoside addition measured ...				Bioorg Med Chem 18: 2645-50 (2010) Article DOI: 10.1016/j.bmc.2010.02.027 BindingDB Entry DOI: 10.7270/Q24F1QVM
					More data for this Ligand-Target Pair
Lysosomal acid glucosylceramidase (Homo sapiens (Human))	BDBM50315253 ((2S,3S,4R,5R,6S)-2-butyl-6-(hydroxymethyl)piperidi...) Show SMILES CCCC[C@H]1N[C@@H](CO)[C@@H](O)[C@H](O)[C@H]1O |r| Show InChI InChI=1S/C10H21NO4/c1-2-3-4-6-8(13)10(15)9(14)7(5-12)11-6/h6-15H,2-5H2,1H3/t6-,7+,8+,9-,10-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.47E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans& CNRS Curated by ChEMBL					Assay Description Inhibition of human recombinant beta-glucocerebrosidase assessed as p-nitrophenolate accumulation preincubated for 10 mins before p-nitrophenyl-beta-...				Bioorg Med Chem 18: 2645-50 (2010) Article DOI: 10.1016/j.bmc.2010.02.027 BindingDB Entry DOI: 10.7270/Q24F1QVM
					More data for this Ligand-Target Pair
Beta-galactosidase (Homo sapiens (Human))	BDBM50235814 (CHEMBL4081472) Show SMILES CCCCC[C@@H]1NC[C@@H](O)[C@@H](O)[C@@H]1CO |r| Show InChI InChI=1S/C11H23NO3/c1-2-3-4-5-9-8(7-13)11(15)10(14)6-12-9/h8-15H,2-7H2,1H3/t8-,9+,10-,11+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans& CNRS Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Eur J Med Chem 126: 160-170 (2017) Article DOI: 10.1016/j.ejmech.2016.09.095 BindingDB Entry DOI: 10.7270/Q21G0PHR
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Beta-hexosaminidase subunit alpha (Homo sapiens (Human))	BDBM50235812 (CHEMBL4085739) Show SMILES CCCCC[C@H]1NC[C@@H](O)[C@@H](O)[C@H]1CO |r| Show InChI InChI=1S/C11H23NO3/c1-2-3-4-5-9-8(7-13)11(15)10(14)6-12-9/h8-15H,2-7H2,1H3/t8-,9+,10+,11-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.60E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans& CNRS Curated by ChEMBL					Assay Description Inhibitory concentration against cyclin dependent kinase-2 (CDK2)/Cyclin E				Eur J Med Chem 126: 160-170 (2017) Article DOI: 10.1016/j.ejmech.2016.09.095 BindingDB Entry DOI: 10.7270/Q21G0PHR
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50061150 (CHEMBL3393680) Show SMILES CCCCCCCCN1C[C@@H](O)[C@H](O)[C@@H](O)[C@H]1CC=C |r| Show InChI InChI=1S/C16H31NO3/c1-3-5-6-7-8-9-11-17-12-14(18)16(20)15(19)13(17)10-4-2/h4,13-16,18-20H,2-3,5-12H2,1H3/t13-,14-,15+,16+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.61E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Strasbourg/CNRS (UMR 7509) Curated by ChEMBL					Assay Description Inhibition of human recombinant serum BuchE using butyrylthiocholine iodide as substrate by Ellman method				Bioorg Med Chem Lett 25: 830-3 (2015) Article DOI: 10.1016/j.bmcl.2014.12.071 BindingDB Entry DOI: 10.7270/Q22B90QH
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50061149 (CHEMBL3393681) Show SMILES CCC[C@@H]1NC[C@@H](O)[C@H](O)[C@H]1O |r| Show InChI InChI=1S/C8H17NO3/c1-2-3-5-7(11)8(12)6(10)4-9-5/h5-12H,2-4H2,1H3/t5-,6+,7-,8-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.10E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Strasbourg/CNRS (UMR 7509) Curated by ChEMBL					Assay Description Inhibition of human recombinant serum BuchE using butyrylthiocholine iodide as substrate by Ellman method				Bioorg Med Chem Lett 25: 830-3 (2015) Article DOI: 10.1016/j.bmcl.2014.12.071 BindingDB Entry DOI: 10.7270/Q22B90QH
					More data for this Ligand-Target Pair
Lysosomal acid glucosylceramidase (Homo sapiens (Human))	BDBM18360 ((2R,3R,4R,5S,6R)-2-(hydroxymethyl)-6-propylpiperid...) Show SMILES CCC[C@H]1N[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O Show InChI InChI=1S/C9H19NO4/c1-2-3-5-7(12)9(14)8(13)6(4-11)10-5/h5-14H,2-4H2,1H3/t5-,6-,7+,8-,9-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans& CNRS Curated by ChEMBL					Assay Description Inhibition of human recombinant beta-glucocerebrosidase preincubated for 10 mins before 4-methylumbelliferyl-betaD-glucopyranoside addition measured ...				Bioorg Med Chem 18: 2645-50 (2010) Article DOI: 10.1016/j.bmc.2010.02.027 BindingDB Entry DOI: 10.7270/Q24F1QVM
					More data for this Ligand-Target Pair
Lysosomal acid glucosylceramidase (Homo sapiens (Human))	BDBM50315251 ((2S,3R,4R,5S,6S)-2-(hydroxymethyl)-6-propylpiperid...) Show SMILES CCC[C@H]1N[C@@H](CO)[C@@H](O)[C@H](O)[C@H]1O |r| Show InChI InChI=1S/C9H19NO4/c1-2-3-5-7(12)9(14)8(13)6(4-11)10-5/h5-14H,2-4H2,1H3/t5-,6+,7+,8-,9-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.87E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans& CNRS Curated by ChEMBL					Assay Description Inhibition of human recombinant beta-glucocerebrosidase assessed as p-nitrophenolate accumulation preincubated for 10 mins before p-nitrophenyl-beta-...				Bioorg Med Chem 18: 2645-50 (2010) Article DOI: 10.1016/j.bmc.2010.02.027 BindingDB Entry DOI: 10.7270/Q24F1QVM
					More data for this Ligand-Target Pair