Compile Data Set for Download or QSAR

Found 63 hits Enz. Inhib. hit(s) with all data for entry = 50047079   

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
Acetylcholinesterase (Homo sapiens (Human))	BDBM8960 ((+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimet...) Show SMILES COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human erythrocyte AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up t...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair				3D Structure (crystal)
Cholinesterase (Equus caballus (Horse))	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 UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair				3D Structure (crystal)
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM8960 ((+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimet...) Show SMILES COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to 180...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50147611 (CHEMBL3764211) Show SMILES Cc1cc(=O)oc2cc(CNCCC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C25H30N2O2/c1-19-15-25(28)29-24-16-22(7-8-23(19)24)17-26-12-9-20-10-13-27(14-11-20)18-21-5-3-2-4-6-21/h2-8,15-16,20,26H,9-14,17-18H2,1H3	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	67	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human erythrocyte AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up t...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					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	110	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to 180...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50147609 (CHEMBL3763535) Show SMILES O=c1oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc2c2CCCCc12 Show InChI InChI=1S/C27H32N2O3/c30-27-25-9-5-4-8-23(25)24-11-10-22(18-26(24)32-27)31-17-14-28-21-12-15-29(16-13-21)19-20-6-2-1-3-7-20/h1-3,6-7,10-11,18,21,28H,4-5,8-9,12-17,19H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	870	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to 180...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50147611 (CHEMBL3764211) Show SMILES Cc1cc(=O)oc2cc(CNCCC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C25H30N2O2/c1-19-15-25(28)29-24-16-22(7-8-23(19)24)17-26-12-9-20-10-13-27(14-11-20)18-21-5-3-2-4-6-21/h2-8,15-16,20,26H,9-14,17-18H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	910	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to 180...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50147609 (CHEMBL3763535) Show SMILES O=c1oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc2c2CCCCc12 Show InChI InChI=1S/C27H32N2O3/c30-27-25-9-5-4-8-23(25)24-11-10-22(18-26(24)32-27)31-17-14-28-21-12-15-29(16-13-21)19-20-6-2-1-3-7-20/h1-3,6-7,10-11,18,21,28H,4-5,8-9,12-17,19H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	930	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50147611 (CHEMBL3764211) Show SMILES Cc1cc(=O)oc2cc(CNCCC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C25H30N2O2/c1-19-15-25(28)29-24-16-22(7-8-23(19)24)17-26-12-9-20-10-13-27(14-11-20)18-21-5-3-2-4-6-21/h2-8,15-16,20,26H,9-14,17-18H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	960	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50147609 (CHEMBL3763535) Show SMILES O=c1oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc2c2CCCCc12 Show InChI InChI=1S/C27H32N2O3/c30-27-25-9-5-4-8-23(25)24-11-10-22(18-26(24)32-27)31-17-14-28-21-12-15-29(16-13-21)19-20-6-2-1-3-7-20/h1-3,6-7,10-11,18,21,28H,4-5,8-9,12-17,19H2	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	1.37E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human erythrocyte AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up t...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50147608 (CHEMBL3764762) Show SMILES Cc1c(Cl)c(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C24H27ClN2O3/c1-17-21-8-7-20(15-22(21)30-24(28)23(17)25)29-14-11-26-19-9-12-27(13-10-19)16-18-5-3-2-4-6-18/h2-8,15,19,26H,9-14,16H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.42E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50147607 (CHEMBL3764609) Show SMILES Cc1c(C)c(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C25H30N2O3/c1-18-19(2)25(28)30-24-16-22(8-9-23(18)24)29-15-12-26-21-10-13-27(14-11-21)17-20-6-4-3-5-7-20/h3-9,16,21,26H,10-15,17H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.48E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to 180...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50147601 (CHEMBL3765293) Show SMILES Clc1cc(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C23H25ClN2O3/c24-21-15-23(27)29-22-14-19(6-7-20(21)22)28-13-10-25-18-8-11-26(12-9-18)16-17-4-2-1-3-5-17/h1-7,14-15,18,25H,8-13,16H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.48E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50147601 (CHEMBL3765293) Show SMILES Clc1cc(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C23H25ClN2O3/c24-21-15-23(27)29-22-14-19(6-7-20(21)22)28-13-10-25-18-8-11-26(12-9-18)16-17-4-2-1-3-5-17/h1-7,14-15,18,25H,8-13,16H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to 180...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50147608 (CHEMBL3764762) Show SMILES Cc1c(Cl)c(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C24H27ClN2O3/c1-17-21-8-7-20(15-22(21)30-24(28)23(17)25)29-14-11-26-19-9-12-27(13-10-19)16-18-5-3-2-4-6-18/h2-8,15,19,26H,9-14,16H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.58E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to 180...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50147607 (CHEMBL3764609) Show SMILES Cc1c(C)c(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C25H30N2O3/c1-18-19(2)25(28)30-24-16-22(8-9-23(18)24)29-15-12-26-21-10-13-27(14-11-21)17-20-6-4-3-5-7-20/h3-9,16,21,26H,10-15,17H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50147608 (CHEMBL3764762) Show SMILES Cc1c(Cl)c(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C24H27ClN2O3/c1-17-21-8-7-20(15-22(21)30-24(28)23(17)25)29-14-11-26-19-9-12-27(13-10-19)16-18-5-3-2-4-6-18/h2-8,15,19,26H,9-14,16H2,1H3	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	1.68E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to ...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50147607 (CHEMBL3764609) Show SMILES Cc1c(C)c(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C25H30N2O3/c1-18-19(2)25(28)30-24-16-22(8-9-23(18)24)29-15-12-26-21-10-13-27(14-11-21)17-20-6-4-3-5-7-20/h3-9,16,21,26H,10-15,17H2,1-2H3	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	1.69E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human erythrocyte AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up t...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50147608 (CHEMBL3764762) Show SMILES Cc1c(Cl)c(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C24H27ClN2O3/c1-17-21-8-7-20(15-22(21)30-24(28)23(17)25)29-14-11-26-19-9-12-27(13-10-19)16-18-5-3-2-4-6-18/h2-8,15,19,26H,9-14,16H2,1H3	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	1.82E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human erythrocyte AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up t...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50147610 (CHEMBL3765442) Show SMILES Cc1cc(=O)oc2cc(CNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C23H26N2O2/c1-17-13-23(26)27-22-14-19(7-8-21(17)22)15-24-20-9-11-25(12-10-20)16-18-5-3-2-4-6-18/h2-8,13-14,20,24H,9-12,15-16H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.93E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B using p-tyramine substrate after 15 mins by fluorimetric analysis				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50147609 (CHEMBL3763535) Show SMILES O=c1oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc2c2CCCCc12 Show InChI InChI=1S/C27H32N2O3/c30-27-25-9-5-4-8-23(25)24-11-10-22(18-26(24)32-27)31-17-14-28-21-12-15-29(16-13-21)19-20-6-2-1-3-7-20/h1-3,6-7,10-11,18,21,28H,4-5,8-9,12-17,19H2	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	1.98E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to ...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50147601 (CHEMBL3765293) Show SMILES Clc1cc(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C23H25ClN2O3/c24-21-15-23(27)29-22-14-19(6-7-20(21)22)28-13-10-25-18-8-11-26(12-9-18)16-17-4-2-1-3-5-17/h1-7,14-15,18,25H,8-13,16H2	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	2.04E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human erythrocyte AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up t...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50147606 (CHEMBL3764644) Show SMILES Cc1cc2ccc(OCCNC3CCN(Cc4ccccc4)CC3)cc2oc1=O Show InChI InChI=1S/C24H28N2O3/c1-18-15-20-7-8-22(16-23(20)29-24(18)27)28-14-11-25-21-9-12-26(13-10-21)17-19-5-3-2-4-6-19/h2-8,15-16,21,25H,9-14,17H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.38E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B using p-tyramine substrate after 15 mins by fluorimetric analysis				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50147609 (CHEMBL3763535) Show SMILES O=c1oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc2c2CCCCc12 Show InChI InChI=1S/C27H32N2O3/c30-27-25-9-5-4-8-23(25)24-11-10-22(18-26(24)32-27)31-17-14-28-21-12-15-29(16-13-21)19-20-6-2-1-3-7-20/h1-3,6-7,10-11,18,21,28H,4-5,8-9,12-17,19H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.62E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B using p-tyramine substrate after 15 mins by fluorimetric analysis				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50147607 (CHEMBL3764609) Show SMILES Cc1c(C)c(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C25H30N2O3/c1-18-19(2)25(28)30-24-16-22(8-9-23(18)24)29-15-12-26-21-10-13-27(14-11-21)17-20-6-4-3-5-7-20/h3-9,16,21,26H,10-15,17H2,1-2H3	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	2.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to ...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM8960 ((+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimet...) Show SMILES COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	2.74E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to ...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50147600 (CHEMBL3764436) Show SMILES Cc1cc(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C24H28N2O3/c1-18-15-24(27)29-23-16-21(7-8-22(18)23)28-14-11-25-20-9-12-26(13-10-20)17-19-5-3-2-4-6-19/h2-8,15-16,20,25H,9-14,17H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.75E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B using p-tyramine substrate after 15 mins by fluorimetric analysis				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50147601 (CHEMBL3765293) Show SMILES Clc1cc(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C23H25ClN2O3/c24-21-15-23(27)29-22-14-19(6-7-20(21)22)28-13-10-25-18-8-11-26(12-9-18)16-17-4-2-1-3-5-17/h1-7,14-15,18,25H,8-13,16H2	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	2.93E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to ...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50147611 (CHEMBL3764211) Show SMILES Cc1cc(=O)oc2cc(CNCCC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C25H30N2O2/c1-19-15-25(28)29-24-16-22(7-8-23(19)24)17-26-12-9-20-10-13-27(14-11-20)18-21-5-3-2-4-6-21/h2-8,15-16,20,26H,9-14,17-18H2,1H3	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	3.45E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to ...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM8960 ((+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimet...) Show SMILES COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	3.79E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50147600 (CHEMBL3764436) Show SMILES Cc1cc(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C24H28N2O3/c1-18-15-24(27)29-23-16-21(7-8-22(18)23)28-14-11-25-20-9-12-26(13-10-20)17-19-5-3-2-4-6-19/h2-8,15-16,20,25H,9-14,17H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.38E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50147597 (CHEMBL3764276) Show SMILES O=c1ccc2ccc(OCCNC3CCN(Cc4ccccc4)CC3)cc2o1 Show InChI InChI=1S/C23H26N2O3/c26-23-9-7-19-6-8-21(16-22(19)28-23)27-15-12-24-20-10-13-25(14-11-20)17-18-4-2-1-3-5-18/h1-9,16,20,24H,10-15,17H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.42E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to 180...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50147597 (CHEMBL3764276) Show SMILES O=c1ccc2ccc(OCCNC3CCN(Cc4ccccc4)CC3)cc2o1 Show InChI InChI=1S/C23H26N2O3/c26-23-9-7-19-6-8-21(16-22(19)28-23)27-15-12-24-20-10-13-25(14-11-20)17-18-4-2-1-3-5-18/h1-9,16,20,24H,10-15,17H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.34E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50147600 (CHEMBL3764436) Show SMILES Cc1cc(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C24H28N2O3/c1-18-15-24(27)29-23-16-21(7-8-22(18)23)28-14-11-25-20-9-12-26(13-10-20)17-19-5-3-2-4-6-19/h2-8,15-16,20,25H,9-14,17H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.62E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to 180...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50147602 (CHEMBL3764166) Show SMILES COc1cc(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C24H28N2O4/c1-28-22-16-24(27)30-23-15-20(7-8-21(22)23)29-14-11-25-19-9-12-26(13-10-19)17-18-5-3-2-4-6-18/h2-8,15-16,19,25H,9-14,17H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.64E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50147606 (CHEMBL3764644) Show SMILES Cc1cc2ccc(OCCNC3CCN(Cc4ccccc4)CC3)cc2oc1=O Show InChI InChI=1S/C24H28N2O3/c1-18-15-20-7-8-22(16-23(20)29-24(18)27)28-14-11-25-21-9-12-26(13-10-21)17-19-5-3-2-4-6-19/h2-8,15-16,21,25H,9-14,17H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.03E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to 180...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50147602 (CHEMBL3764166) Show SMILES COc1cc(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C24H28N2O4/c1-28-22-16-24(27)30-23-15-20(7-8-21(22)23)29-14-11-25-19-9-12-26(13-10-19)17-18-5-3-2-4-6-18/h2-8,15-16,19,25H,9-14,17H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.29E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to 180...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50147603 (CHEMBL3764112) Show SMILES CCOc1cc(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C25H30N2O4/c1-2-29-23-17-25(28)31-24-16-21(8-9-22(23)24)30-15-12-26-20-10-13-27(14-11-20)18-19-6-4-3-5-7-19/h3-9,16-17,20,26H,2,10-15,18H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.34E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to 180...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM29136 (CHEMBL92401 | Euphozid | Iprazid | Iproniazid) Show SMILES CC(C)NNC(=O)c1ccncc1 Show InChI InChI=1S/C9H13N3O/c1-7(2)11-12-9(13)8-3-5-10-6-4-8/h3-7,11H,1-2H3,(H,12,13)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.57E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-A using p-tyramine substrate after 15 mins by fluorimetric analysis				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50147603 (CHEMBL3764112) Show SMILES CCOc1cc(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C25H30N2O4/c1-2-29-23-17-25(28)31-24-16-21(8-9-22(23)24)30-15-12-26-20-10-13-27(14-11-20)18-19-6-4-3-5-7-19/h3-9,16-17,20,26H,2,10-15,18H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.95E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50147610 (CHEMBL3765442) Show SMILES Cc1cc(=O)oc2cc(CNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C23H26N2O2/c1-17-13-23(26)27-22-14-19(7-8-21(17)22)15-24-20-9-11-25(12-10-20)16-18-5-3-2-4-6-18/h2-8,13-14,20,24H,9-12,15-16H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.28E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to 180...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50147606 (CHEMBL3764644) Show SMILES Cc1cc2ccc(OCCNC3CCN(Cc4ccccc4)CC3)cc2oc1=O Show InChI InChI=1S/C24H28N2O3/c1-18-15-20-7-8-22(16-23(20)29-24(18)27)28-14-11-25-21-9-12-26(13-10-21)17-19-5-3-2-4-6-19/h2-8,15-16,21,25H,9-14,17H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.53E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM29136 (CHEMBL92401 | Euphozid | Iprazid | Iproniazid) Show SMILES CC(C)NNC(=O)c1ccncc1 Show InChI InChI=1S/C9H13N3O/c1-7(2)11-12-9(13)8-3-5-10-6-4-8/h3-7,11H,1-2H3,(H,12,13)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7.97E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B using p-tyramine substrate after 15 mins by fluorimetric analysis				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50147597 (CHEMBL3764276) Show SMILES O=c1ccc2ccc(OCCNC3CCN(Cc4ccccc4)CC3)cc2o1 Show InChI InChI=1S/C23H26N2O3/c26-23-9-7-19-6-8-21(16-22(19)28-23)27-15-12-24-20-10-13-25(14-11-20)17-18-4-2-1-3-5-18/h1-9,16,20,24H,10-15,17H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.39E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B using p-tyramine substrate after 15 mins by fluorimetric analysis				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50147599 (CHEMBL3765760) Show SMILES O=c1ccc2ccc(OCCNCCC3CCN(Cc4ccccc4)CC3)cc2o1 Show InChI InChI=1S/C25H30N2O3/c28-25-9-7-22-6-8-23(18-24(22)30-25)29-17-14-26-13-10-20-11-15-27(16-12-20)19-21-4-2-1-3-5-21/h1-9,18,20,26H,10-17,19H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.91E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to 180...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50147605 (CHEMBL3764334) Show SMILES O=c1cc(-c2ccccc2)c2ccc(OCCNC3CCN(Cc4ccccc4)CC3)cc2o1 Show InChI InChI=1S/C29H30N2O3/c32-29-20-27(23-9-5-2-6-10-23)26-12-11-25(19-28(26)34-29)33-18-15-30-24-13-16-31(17-14-24)21-22-7-3-1-4-8-22/h1-12,19-20,24,30H,13-18,21H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.93E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50147604 (CHEMBL3764408) Show SMILES FC(F)(F)c1cc(=O)oc2cc(OCCNC3CCN(Cc4ccccc4)CC3)ccc12 Show InChI InChI=1S/C24H25F3N2O3/c25-24(26,27)21-15-23(30)32-22-14-19(6-7-20(21)22)31-13-10-28-18-8-11-29(12-9-18)16-17-4-2-1-3-5-17/h1-7,14-15,18,28H,8-13,16H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.18E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to 180...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50147605 (CHEMBL3764334) Show SMILES O=c1cc(-c2ccccc2)c2ccc(OCCNC3CCN(Cc4ccccc4)CC3)cc2o1 Show InChI InChI=1S/C29H30N2O3/c32-29-20-27(23-9-5-2-6-10-23)26-12-11-25(19-28(26)34-29)33-18-15-30-24-13-16-31(17-14-24)21-22-7-3-1-4-8-22/h1-12,19-20,24,30H,13-18,21H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.65E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to 180...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50147599 (CHEMBL3765760) Show SMILES O=c1ccc2ccc(OCCNCCC3CCN(Cc4ccccc4)CC3)cc2o1 Show InChI InChI=1S/C25H30N2O3/c28-25-9-7-22-6-8-23(18-24(22)30-25)29-17-14-26-13-10-20-11-15-27(16-12-20)19-21-4-2-1-3-5-21/h1-9,18,20,26H,10-17,19H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.79E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50147598 (CHEMBL3763819) Show SMILES O=c1ccc2ccc(OCCCNC3CCN(Cc4ccccc4)CC3)cc2o1 Show InChI InChI=1S/C24H28N2O3/c27-24-10-8-20-7-9-22(17-23(20)29-24)28-16-4-13-25-21-11-14-26(15-12-21)18-19-5-2-1-3-6-19/h1-3,5-10,17,21,25H,4,11-16,18H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.86E+3	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins followed by substrate addition measured up to...				Bioorg Med Chem 24: 1528-39 (2016) Article DOI: 10.1016/j.bmc.2016.02.023 BindingDB Entry DOI: 10.7270/Q2125VHK
					More data for this Ligand-Target Pair

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