Compile Data Set for Download or QSAR

Found 73 hits Enz. Inhib. hit(s) with all data for entry = 50009424   

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
Amyloid-beta precursor protein (Homo sapiens (Human))	BDBM50528756 (CHEMBL4470128) Show SMILES CN(C)c1ccc(cn1)-c1nc2cc([125I])ccc2o1 Show InChI InChI=1S/C14H12IN3O/c1-18(2)13-6-3-9(8-16-13)14-17-11-7-10(15)4-5-12(11)19-14/h3-8H,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	6.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Displacement of [125I]IMPY from human amyloid beta(1-42) aggregates incubated for 3 hrs by gamma counting analysis				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528740 (CHEMBL4536953) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccc(Br)cc1 Show InChI InChI=1S/C18H17BrN4O2/c19-13-3-1-12(2-4-13)17(24)22-7-9-23(10-8-22)18-21-15-11-14(20)5-6-16(15)25-18/h1-6,11H,7-10,20H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Non-competitive inhibition of electric eel AChE using varying levels of acetylthiocholine iodide as substrate measured at 2 mins interval for 10 mins...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50528740 (CHEMBL4536953) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccc(Br)cc1 Show InChI InChI=1S/C18H17BrN4O2/c19-13-3-1-12(2-4-13)17(24)22-7-9-23(10-8-22)18-21-15-11-14(20)5-6-16(15)25-18/h1-6,11H,7-10,20H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	860	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Non-competitive inhibition of equine serum BuChE using varying levels of butyrylthiocholine iodide as substrate measured at 2 mins interval for 10 mi...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50291665 (CHEMBL4165327) Show SMILES [Br-].COc1cc2CC(Cc3cc[n+](Cc4ccccc4)cc3Br)C(=O)c2cc1OC Show InChI InChI=1S/C24H23BrNO3.BrH/c1-28-22-12-18-11-19(24(27)20(18)13-23(22)29-2)10-17-8-9-26(15-21(17)25)14-16-6-4-3-5-7-16;/h3-9,12-13,15,19H,10-11,14H2,1-2H3;1H/q+1;/p-1	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.360	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
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	22	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50197875 (CHEMBL3910142) Show SMILES Oc1cccc2ccc(CN(CC#C)C(CCC3CCN(Cc4ccccc4)CC3)C#N)nc12 Show InChI InChI=1S/C29H32N4O/c1-2-17-33(22-26-13-12-25-9-6-10-28(34)29(25)31-26)27(20-30)14-11-23-15-18-32(19-16-23)21-24-7-4-3-5-8-24/h1,3-10,12-13,23,27,34H,11,14-19,21-22H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528740 (CHEMBL4536953) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccc(Br)cc1 Show InChI InChI=1S/C18H17BrN4O2/c19-13-3-1-12(2-4-13)17(24)22-7-9-23(10-8-22)18-21-15-11-14(20)5-6-16(15)25-18/h1-6,11H,7-10,20H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	52	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528749 (CHEMBL4462677) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccc(F)cc1 Show InChI InChI=1S/C18H17FN4O2/c19-13-3-1-12(2-4-13)17(24)22-7-9-23(10-8-22)18-21-15-11-14(20)5-6-16(15)25-18/h1-6,11H,7-10,20H2	UniProtKB/SwissProt 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
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528754 (CHEMBL4522175) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C18H17ClN4O2/c19-13-3-1-12(2-4-13)17(24)22-7-9-23(10-8-22)18-21-15-11-14(20)5-6-16(15)25-18/h1-6,11H,7-10,20H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	109	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528748 (CHEMBL4442490) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1cccc(Br)c1 Show InChI InChI=1S/C18H17BrN4O2/c19-13-3-1-2-12(10-13)17(24)22-6-8-23(9-7-22)18-21-15-11-14(20)4-5-16(15)25-18/h1-5,10-11H,6-9,20H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	163	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528730 (CHEMBL4450353) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1cccc(F)c1 Show InChI InChI=1S/C18H17FN4O2/c19-13-3-1-2-12(10-13)17(24)22-6-8-23(9-7-22)18-21-15-11-14(20)4-5-16(15)25-18/h1-5,10-11H,6-9,20H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	231	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528728 (CHEMBL4474948) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1cccc(Cl)c1 Show InChI InChI=1S/C18H17ClN4O2/c19-13-3-1-2-12(10-13)17(24)22-6-8-23(9-7-22)18-21-15-11-14(20)4-5-16(15)25-18/h1-5,10-11H,6-9,20H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	241	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528729 (CHEMBL4472865) Show SMILES COc1ccc(cc1)C(=O)N1CCN(CC1)c1nc2cc(N)ccc2o1 Show InChI InChI=1S/C19H20N4O3/c1-25-15-5-2-13(3-6-15)18(24)22-8-10-23(11-9-22)19-21-16-12-14(20)4-7-17(16)26-19/h2-7,12H,8-11,20H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	275	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528744 (CHEMBL4569192) Show SMILES COc1ccc(Cl)cc1C(=O)N1CCN(CC1)c1nc2cc(N)ccc2o1 Show InChI InChI=1S/C19H19ClN4O3/c1-26-16-4-2-12(20)10-14(16)18(25)23-6-8-24(9-7-23)19-22-15-11-13(21)3-5-17(15)27-19/h2-5,10-11H,6-9,21H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	321	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528741 (CHEMBL4435341) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccccc1F Show InChI InChI=1S/C18H17FN4O2/c19-14-4-2-1-3-13(14)17(24)22-7-9-23(10-8-22)18-21-15-11-12(20)5-6-16(15)25-18/h1-6,11H,7-10,20H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	337	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528745 (CHEMBL4473288) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(Cc2ccc(Br)cc2)CC1 Show InChI InChI=1S/C18H19BrN4O/c19-14-3-1-13(2-4-14)12-22-7-9-23(10-8-22)18-21-16-11-15(20)5-6-17(16)24-18/h1-6,11H,7-10,12,20H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	379	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528725 (CHEMBL4518306) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CCc2ccccc2)CC1 Show InChI InChI=1S/C19H22N4O/c20-16-6-7-18-17(14-16)21-19(24-18)23-12-10-22(11-13-23)9-8-15-4-2-1-3-5-15/h1-7,14H,8-13,20H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	393	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528739 (CHEMBL4588952) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccccc1Br Show InChI InChI=1S/C18H17BrN4O2/c19-14-4-2-1-3-13(14)17(24)22-7-9-23(10-8-22)18-21-15-11-12(20)5-6-16(15)25-18/h1-6,11H,7-10,20H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	445	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528755 (CHEMBL4557653) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(Cc2ccc(F)cc2)CC1 Show InChI InChI=1S/C18H19FN4O/c19-14-3-1-13(2-4-14)12-22-7-9-23(10-8-22)18-21-16-11-15(20)5-6-17(16)24-18/h1-6,11H,7-10,12,20H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	525	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528743 (CHEMBL4439615) Show SMILES COc1cccc(c1)C(=O)N1CCN(CC1)c1nc2cc(N)ccc2o1 Show InChI InChI=1S/C19H20N4O3/c1-25-15-4-2-3-13(11-15)18(24)22-7-9-23(10-8-22)19-21-16-12-14(20)5-6-17(16)26-19/h2-6,11-12H,7-10,20H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528758 (CHEMBL4574930) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccccc1Cl Show InChI InChI=1S/C18H17ClN4O2/c19-14-4-2-1-3-13(14)17(24)22-7-9-23(10-8-22)18-21-15-11-12(20)5-6-16(15)25-18/h1-6,11H,7-10,20H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	559	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528737 (CHEMBL4545023) Show SMILES Nc1ccc2oc(NC3CCN(Cc4ccccc4)CC3)nc2c1 Show InChI InChI=1S/C19H22N4O/c20-15-6-7-18-17(12-15)22-19(24-18)21-16-8-10-23(11-9-16)13-14-4-2-1-3-5-14/h1-7,12,16H,8-11,13,20H2,(H,21,22)	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	559	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528750 (CHEMBL4453853) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccc2OCOc2c1 Show InChI InChI=1S/C19H18N4O4/c20-13-2-4-15-14(10-13)21-19(27-15)23-7-5-22(6-8-23)18(24)12-1-3-16-17(9-12)26-11-25-16/h1-4,9-10H,5-8,11,20H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	616	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528751 (CHEMBL4476086) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(Cc2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C18H19ClN4O/c19-14-3-1-13(2-4-14)12-22-7-9-23(10-8-22)18-21-16-11-15(20)5-6-17(16)24-18/h1-6,11H,7-10,12,20H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	747	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528731 (CHEMBL4442752) Show SMILES COc1ccc(CN2CCN(CC2)c2nc3cc(N)ccc3o2)cc1 Show InChI InChI=1S/C19H22N4O2/c1-24-16-5-2-14(3-6-16)13-22-8-10-23(11-9-22)19-21-17-12-15(20)4-7-18(17)25-19/h2-7,12H,8-11,13,20H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	748	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528738 (CHEMBL4589809) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccccc1 Show InChI InChI=1S/C18H18N4O2/c19-14-6-7-16-15(12-14)20-18(24-16)22-10-8-21(9-11-22)17(23)13-4-2-1-3-5-13/h1-7,12H,8-11,19H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	801	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528746 (CHEMBL4566824) Show SMILES Cc1ccc(CN2CCN(CC2)c2nc3cc(N)ccc3o2)cc1 Show InChI InChI=1S/C19H22N4O/c1-14-2-4-15(5-3-14)13-22-8-10-23(11-9-22)19-21-17-12-16(20)6-7-18(17)24-19/h2-7,12H,8-11,13,20H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	807	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50528749 (CHEMBL4462677) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccc(F)cc1 Show InChI InChI=1S/C18H17FN4O2/c19-13-3-1-12(2-4-13)17(24)22-7-9-23(10-8-22)18-21-15-11-14(20)5-6-16(15)25-18/h1-6,11H,7-10,20H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	817	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 30 mins followed by substrate addition and measured fo...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528726 (CHEMBL4451956) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C18H20N4O/c19-15-6-7-17-16(12-15)20-18(23-17)22-10-8-21(9-11-22)13-14-4-2-1-3-5-14/h1-7,12H,8-11,13,19H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	921	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528742 (CHEMBL4515408) Show SMILES COc1ccccc1C(=O)N1CCN(CC1)c1nc2cc(N)ccc2o1 Show InChI InChI=1S/C19H20N4O3/c1-25-16-5-3-2-4-14(16)18(24)22-8-10-23(11-9-22)19-21-15-12-13(20)6-7-17(15)26-19/h2-7,12H,8-11,20H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	927	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					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	941	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 30 mins followed by substrate addition and measured fo...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528752 (CHEMBL4457720) Show SMILES CC(C)c1ccc(CN2CCN(CC2)c2nc3cc(N)ccc3o2)cc1 Show InChI InChI=1S/C21H26N4O/c1-15(2)17-5-3-16(4-6-17)14-24-9-11-25(12-10-24)21-23-19-13-18(22)7-8-20(19)26-21/h3-8,13,15H,9-12,14,22H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	943	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50528725 (CHEMBL4518306) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CCc2ccccc2)CC1 Show InChI InChI=1S/C19H22N4O/c20-16-6-7-18-17(14-16)21-19(24-18)23-12-10-22(11-13-23)9-8-15-4-2-1-3-5-15/h1-7,14H,8-13,20H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	957	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 30 mins followed by substrate addition and measured fo...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528734 (CHEMBL4575964) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)c1ccc(Br)cc1 Show InChI InChI=1S/C17H17BrN4O/c18-12-1-4-14(5-2-12)21-7-9-22(10-8-21)17-20-15-11-13(19)3-6-16(15)23-17/h1-6,11H,7-10,19H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.06E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50528740 (CHEMBL4536953) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccc(Br)cc1 Show InChI InChI=1S/C18H17BrN4O2/c19-13-3-1-12(2-4-13)17(24)22-7-9-23(10-8-22)18-21-15-11-14(20)5-6-16(15)25-18/h1-6,11H,7-10,20H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.09E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 30 mins followed by substrate addition and measured fo...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50528744 (CHEMBL4569192) Show SMILES COc1ccc(Cl)cc1C(=O)N1CCN(CC1)c1nc2cc(N)ccc2o1 Show InChI InChI=1S/C19H19ClN4O3/c1-26-16-4-2-12(20)10-14(16)18(25)23-6-8-24(9-7-23)19-22-15-11-13(21)3-5-17(15)27-19/h2-5,10-11H,6-9,21H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.37E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 30 mins followed by substrate addition and measured fo...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528747 (CHEMBL4474675) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)c1ccc(F)cc1 Show InChI InChI=1S/C17H17FN4O/c18-12-1-4-14(5-2-12)21-7-9-22(10-8-21)17-20-15-11-13(19)3-6-16(15)23-17/h1-6,11H,7-10,19H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.45E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50528750 (CHEMBL4453853) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccc2OCOc2c1 Show InChI InChI=1S/C19H18N4O4/c20-13-2-4-15-14(10-13)21-19(27-15)23-7-5-22(6-8-23)18(24)12-1-3-16-17(9-12)26-11-25-16/h1-4,9-10H,5-8,11,20H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.52E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 30 mins followed by substrate addition and measured fo...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528733 (CHEMBL4565910) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)c1ccc(Cl)cc1 Show InChI InChI=1S/C17H17ClN4O/c18-12-1-4-14(5-2-12)21-7-9-22(10-8-21)17-20-15-11-13(19)3-6-16(15)23-17/h1-6,11H,7-10,19H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.96E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528727 (CHEMBL4437417) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)c1ccccc1 Show InChI InChI=1S/C17H18N4O/c18-13-6-7-16-15(12-13)19-17(22-16)21-10-8-20(9-11-21)14-4-2-1-3-5-14/h1-7,12H,8-11,18H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.09E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528735 (CHEMBL4439886) Show SMILES COc1ccc(cc1)N1CCN(CC1)c1nc2cc(N)ccc2o1 Show InChI InChI=1S/C18H20N4O2/c1-23-15-5-3-14(4-6-15)21-8-10-22(11-9-21)18-20-16-12-13(19)2-7-17(16)24-18/h2-7,12H,8-11,19H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50528737 (CHEMBL4545023) Show SMILES Nc1ccc2oc(NC3CCN(Cc4ccccc4)CC3)nc2c1 Show InChI InChI=1S/C19H22N4O/c20-15-6-7-18-17(12-15)22-19(24-18)21-16-8-10-23(11-9-16)13-14-4-2-1-3-5-14/h1-7,12,16H,8-11,13,20H2,(H,21,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.27E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 30 mins followed by substrate addition and measured fo...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50528748 (CHEMBL4442490) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1cccc(Br)c1 Show InChI InChI=1S/C18H17BrN4O2/c19-13-3-1-2-12(10-13)17(24)22-6-8-23(9-7-22)18-21-15-11-14(20)4-5-16(15)25-18/h1-5,10-11H,6-9,20H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.68E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 30 mins followed by substrate addition and measured fo...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50528745 (CHEMBL4473288) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(Cc2ccc(Br)cc2)CC1 Show InChI InChI=1S/C18H19BrN4O/c19-14-3-1-13(2-4-14)12-22-7-9-23(10-8-22)18-21-16-11-15(20)5-6-17(16)24-18/h1-6,11H,7-10,12,20H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.97E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 30 mins followed by substrate addition and measured fo...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50528755 (CHEMBL4557653) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(Cc2ccc(F)cc2)CC1 Show InChI InChI=1S/C18H19FN4O/c19-14-3-1-13(2-4-14)12-22-7-9-23(10-8-22)18-21-16-11-15(20)5-6-17(16)24-18/h1-6,11H,7-10,12,20H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.11E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 30 mins followed by substrate addition and measured fo...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528736 (CHEMBL4529285) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)c1ccccn1 Show InChI InChI=1S/C16H17N5O/c17-12-4-5-14-13(11-12)19-16(22-14)21-9-7-20(8-10-21)15-3-1-2-6-18-15/h1-6,11H,7-10,17H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.31E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50528754 (CHEMBL4522175) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C18H17ClN4O2/c19-13-3-1-12(2-4-13)17(24)22-7-9-23(10-8-22)18-21-15-11-14(20)5-6-16(15)25-18/h1-6,11H,7-10,20H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.32E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 30 mins followed by substrate addition and measured fo...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50528751 (CHEMBL4476086) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(Cc2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C18H19ClN4O/c19-14-3-1-13(2-4-14)12-22-7-9-23(10-8-22)18-21-16-11-15(20)5-6-17(16)24-18/h1-6,11H,7-10,12,20H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.85E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 30 mins followed by substrate addition and measured fo...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50528757 (CHEMBL4450342) Show SMILES Cc1ccc(cc1)N1CCN(CC1)c1nc2cc(N)ccc2o1 Show InChI InChI=1S/C18H20N4O/c1-13-2-5-15(6-3-13)21-8-10-22(11-9-21)18-20-16-12-14(19)4-7-17(16)23-18/h2-7,12H,8-11,19H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.18E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated with enzyme for 30 mins followed by substrate addition and m...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50528728 (CHEMBL4474948) Show SMILES Nc1ccc2oc(nc2c1)N1CCN(CC1)C(=O)c1cccc(Cl)c1 Show InChI InChI=1S/C18H17ClN4O2/c19-13-3-1-2-12(10-13)17(24)22-6-8-23(9-7-22)18-21-15-11-14(20)4-5-16(15)25-18/h1-5,10-11H,6-9,20H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.56E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indian Institute of Technology (Banaras Hindu University) Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated for 30 mins followed by substrate addition and measured fo...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111613 BindingDB Entry DOI: 10.7270/Q2GQ726C
					More data for this Ligand-Target Pair

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