Compile Data Set for Download or QSAR

Found 65 hits with Last Name = 'xie' and Initial = 'sq'   

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 (Electrophorus electricus (Electric eel))	BDBM50140562 (CHEMBL3753044) Show SMILES O=c1cc(oc2cc(OCCCCCCCCN3CCCC3)ccc12)-c1cccc2ccccc12 Show InChI InChI=1S/C31H35NO3/c33-29-23-31(27-15-11-13-24-12-5-6-14-26(24)27)35-30-22-25(16-17-28(29)30)34-21-10-4-2-1-3-7-18-32-19-8-9-20-32/h5-6,11-17,22-23H,1-4,7-10,18-21H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	206	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Mixed-type inhibition of electric eel AChE using ATC as substrate assessed as hydrolysis of ATC preincubated with protein for 15 mins followed by sub...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50200130 (CHEMBL3950279) Show SMILES CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCCCCCCCNc3c4CCCCc4nc4ccccc34)cc2o1 Show InChI InChI=1S/C40H46N4O4/c1-44(2)29-19-17-28(18-20-29)37-26-36(45)33-22-21-30(25-38(33)48-37)47-27-39(46)41-23-11-5-3-4-6-12-24-42-40-31-13-7-9-15-34(31)43-35-16-10-8-14-32(35)40/h7,9,13,15,17-22,25-26H,3-6,8,10-12,14,16,23-24,27H2,1-2H3,(H,41,46)(H,42,43)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition by UV-spectrophotometric analysis				Eur J Med Chem 122: 17-26 (2016) Article DOI: 10.1016/j.ejmech.2016.06.022 BindingDB Entry DOI: 10.7270/Q2QZ2CX6
					More data for this Ligand-Target Pair
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	37	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition by UV-spectrophotometric analysis				Eur J Med Chem 122: 17-26 (2016) Article DOI: 10.1016/j.ejmech.2016.06.022 BindingDB Entry DOI: 10.7270/Q2QZ2CX6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Cholinesterase (Equus caballus (Horse))	BDBM50199714 (CHEMBL3922564) Show SMILES CCn1nc(-c2ccccc2)c(C(C)=O)c(Nc2ccc(cc2)C(O)=O)c1=O Show InChI InChI=1S/C21H19N3O4/c1-3-24-20(26)19(22-16-11-9-15(10-12-16)21(27)28)17(13(2)25)18(23-24)14-7-5-4-6-8-14/h4-12,22H,3H2,1-2H3,(H,27,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	46	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition by UV-spectrophotometric analysis				Eur J Med Chem 122: 17-26 (2016) Article DOI: 10.1016/j.ejmech.2016.06.022 BindingDB Entry DOI: 10.7270/Q2QZ2CX6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50199714 (CHEMBL3922564) Show SMILES CCn1nc(-c2ccccc2)c(C(C)=O)c(Nc2ccc(cc2)C(O)=O)c1=O Show InChI InChI=1S/C21H19N3O4/c1-3-24-20(26)19(22-16-11-9-15(10-12-16)21(27)28)17(13(2)25)18(23-24)14-7-5-4-6-8-14/h4-12,22H,3H2,1-2H3,(H,27,28)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition by UV-spectrophotometric analysis				Eur J Med Chem 122: 17-26 (2016) Article DOI: 10.1016/j.ejmech.2016.06.022 BindingDB Entry DOI: 10.7270/Q2QZ2CX6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50200130 (CHEMBL3950279) Show SMILES CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCCCCCCCNc3c4CCCCc4nc4ccccc34)cc2o1 Show InChI InChI=1S/C40H46N4O4/c1-44(2)29-19-17-28(18-20-29)37-26-36(45)33-22-21-30(25-38(33)48-37)47-27-39(46)41-23-11-5-3-4-6-12-24-42-40-31-13-7-9-15-34(31)43-35-16-10-8-14-32(35)40/h7,9,13,15,17-22,25-26H,3-6,8,10-12,14,16,23-24,27H2,1-2H3,(H,41,46)(H,42,43)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	95	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition by UV-spectrophotometric analysis				Eur J Med Chem 122: 17-26 (2016) Article DOI: 10.1016/j.ejmech.2016.06.022 BindingDB Entry DOI: 10.7270/Q2QZ2CX6
					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	193	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition by UV-spectrophotometric analysis				Eur J Med Chem 122: 17-26 (2016) Article DOI: 10.1016/j.ejmech.2016.06.022 BindingDB Entry DOI: 10.7270/Q2QZ2CX6
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50200131 (CHEMBL3968969) Show SMILES CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C31H41N3O4/c1-33(2)25-13-11-24(12-14-25)29-22-28(35)27-16-15-26(21-30(27)38-29)37-23-31(36)32-17-7-5-3-4-6-8-18-34-19-9-10-20-34/h11-16,21-22H,3-10,17-20,23H2,1-2H3,(H,32,36)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	238	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition by UV-spectrophotometric analysis				Eur J Med Chem 122: 17-26 (2016) Article DOI: 10.1016/j.ejmech.2016.06.022 BindingDB Entry DOI: 10.7270/Q2QZ2CX6
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50200128 (CHEMBL3931477) Show SMILES CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCCNc3c4CCCCc4nc4ccccc34)cc2o1 Show InChI InChI=1S/C35H36N4O4/c1-39(2)24-14-12-23(13-15-24)32-21-31(40)28-17-16-25(20-33(28)43-32)42-22-34(41)36-18-7-19-37-35-26-8-3-5-10-29(26)38-30-11-6-4-9-27(30)35/h3,5,8,10,12-17,20-21H,4,6-7,9,11,18-19,22H2,1-2H3,(H,36,41)(H,37,38)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	266	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition by UV-spectrophotometric analysis				Eur J Med Chem 122: 17-26 (2016) Article DOI: 10.1016/j.ejmech.2016.06.022 BindingDB Entry DOI: 10.7270/Q2QZ2CX6
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50200122 (CHEMBL3958981) Show SMILES CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCCCNc3c4CCCCc4nc4ccccc34)cc2o1 Show InChI InChI=1S/C36H38N4O4/c1-40(2)25-15-13-24(14-16-25)33-22-32(41)29-18-17-26(21-34(29)44-33)43-23-35(42)37-19-7-8-20-38-36-27-9-3-5-11-30(27)39-31-12-6-4-10-28(31)36/h3,5,9,11,13-18,21-22H,4,6-8,10,12,19-20,23H2,1-2H3,(H,37,42)(H,38,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	335	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition by UV-spectrophotometric analysis				Eur J Med Chem 122: 17-26 (2016) Article DOI: 10.1016/j.ejmech.2016.06.022 BindingDB Entry DOI: 10.7270/Q2QZ2CX6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50200126 (CHEMBL3892539) Show SMILES CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCNc3c4CCCCc4nc4ccccc34)cc2o1 Show InChI InChI=1S/C34H34N4O4/c1-38(2)23-13-11-22(12-14-23)31-20-30(39)27-16-15-24(19-32(27)42-31)41-21-33(40)35-17-18-36-34-25-7-3-5-9-28(25)37-29-10-6-4-8-26(29)34/h3,5,7,9,11-16,19-20H,4,6,8,10,17-18,21H2,1-2H3,(H,35,40)(H,36,37)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	418	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition by UV-spectrophotometric analysis				Eur J Med Chem 122: 17-26 (2016) Article DOI: 10.1016/j.ejmech.2016.06.022 BindingDB Entry DOI: 10.7270/Q2QZ2CX6
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50140562 (CHEMBL3753044) Show SMILES O=c1cc(oc2cc(OCCCCCCCCN3CCCC3)ccc12)-c1cccc2ccccc12 Show InChI InChI=1S/C31H35NO3/c33-29-23-31(27-15-11-13-24-12-5-6-14-26(24)27)35-30-22-25(16-17-28(29)30)34-21-10-4-2-1-3-7-18-32-19-8-9-20-32/h5-6,11-17,22-23H,1-4,7-10,18-21H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	420	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of equine serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50140559 (CHEMBL3753823) Show SMILES COc1ccccc1-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C28H35NO4/c1-31-26-13-7-6-12-24(26)28-21-25(30)23-15-14-22(20-27(23)33-28)32-19-11-5-3-2-4-8-16-29-17-9-10-18-29/h6-7,12-15,20-21H,2-5,8-11,16-19H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	640	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50140547 (CHEMBL3753214) Show SMILES COc1cccc(c1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C28H35NO4/c1-31-23-12-10-11-22(19-23)27-21-26(30)25-14-13-24(20-28(25)33-27)32-18-9-5-3-2-4-6-15-29-16-7-8-17-29/h10-14,19-21H,2-9,15-18H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	670	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50140562 (CHEMBL3753044) Show SMILES O=c1cc(oc2cc(OCCCCCCCCN3CCCC3)ccc12)-c1cccc2ccccc12 Show InChI InChI=1S/C31H35NO3/c33-29-23-31(27-15-11-13-24-12-5-6-14-26(24)27)35-30-22-25(16-17-28(29)30)34-21-10-4-2-1-3-7-18-32-19-8-9-20-32/h5-6,11-17,22-23H,1-4,7-10,18-21H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	720	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50140559 (CHEMBL3753823) Show SMILES COc1ccccc1-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C28H35NO4/c1-31-26-13-7-6-12-24(26)28-21-25(30)23-15-14-22(20-27(23)33-28)32-19-11-5-3-2-4-8-16-29-17-9-10-18-29/h6-7,12-15,20-21H,2-5,8-11,16-19H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	760	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of equine serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50200128 (CHEMBL3931477) Show SMILES CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCCNc3c4CCCCc4nc4ccccc34)cc2o1 Show InChI InChI=1S/C35H36N4O4/c1-39(2)24-14-12-23(13-15-24)32-21-31(40)28-17-16-25(20-33(28)43-32)42-22-34(41)36-18-7-19-37-35-26-8-3-5-10-29(26)38-30-11-6-4-9-27(30)35/h3,5,8,10,12-17,20-21H,4,6-7,9,11,18-19,22H2,1-2H3,(H,36,41)(H,37,38)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	769	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition by UV-spectrophotometric analysis				Eur J Med Chem 122: 17-26 (2016) Article DOI: 10.1016/j.ejmech.2016.06.022 BindingDB Entry DOI: 10.7270/Q2QZ2CX6
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50200126 (CHEMBL3892539) Show SMILES CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCNc3c4CCCCc4nc4ccccc34)cc2o1 Show InChI InChI=1S/C34H34N4O4/c1-38(2)23-13-11-22(12-14-23)31-20-30(39)27-16-15-24(19-32(27)42-31)41-21-33(40)35-17-18-36-34-25-7-3-5-9-28(25)37-29-10-6-4-8-26(29)34/h3,5,7,9,11-16,19-20H,4,6,8,10,17-18,21H2,1-2H3,(H,35,40)(H,36,37)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	814	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition by UV-spectrophotometric analysis				Eur J Med Chem 122: 17-26 (2016) Article DOI: 10.1016/j.ejmech.2016.06.022 BindingDB Entry DOI: 10.7270/Q2QZ2CX6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50140511 (CHEMBL3753742) Show SMILES COc1ccc(cc1OC)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C29H37NO5/c1-32-26-14-11-22(19-29(26)33-2)27-21-25(31)24-13-12-23(20-28(24)35-27)34-18-10-6-4-3-5-7-15-30-16-8-9-17-30/h11-14,19-21H,3-10,15-18H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	830	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50140456 (CHEMBL3754793) Show SMILES COc1cc(cc(OC)c1OC)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C30H39NO6/c1-33-28-18-22(19-29(34-2)30(28)35-3)26-21-25(32)24-13-12-23(20-27(24)37-26)36-17-11-7-5-4-6-8-14-31-15-9-10-16-31/h12-13,18-21H,4-11,14-17H2,1-3H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.08E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50140560 (CHEMBL3753043) Show SMILES O=c1cc(oc2cc(OCCCCCCCCN3CCCC3)ccc12)-c1ccccc1 Show InChI InChI=1S/C27H33NO3/c29-25-21-26(22-12-6-5-7-13-22)31-27-20-23(14-15-24(25)27)30-19-11-4-2-1-3-8-16-28-17-9-10-18-28/h5-7,12-15,20-21H,1-4,8-11,16-19H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.09E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50140452 (CHEMBL3752831) Show SMILES Oc1cccc(c1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C27H33NO4/c29-22-11-9-10-21(18-22)26-20-25(30)24-13-12-23(19-27(24)32-26)31-17-8-4-2-1-3-5-14-28-15-6-7-16-28/h9-13,18-20,29H,1-8,14-17H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.12E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50140565 (CHEMBL3753905) Show SMILES Clc1ccc(cc1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C27H32ClNO3/c28-22-11-9-21(10-12-22)26-20-25(30)24-14-13-23(19-27(24)32-26)31-18-8-4-2-1-3-5-15-29-16-6-7-17-29/h9-14,19-20H,1-8,15-18H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.12E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50140450 (CHEMBL3754159) Show SMILES Oc1ccc(cc1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C27H33NO4/c29-22-11-9-21(10-12-22)26-20-25(30)24-14-13-23(19-27(24)32-26)31-18-8-4-2-1-3-5-15-28-16-6-7-17-28/h9-14,19-20,29H,1-8,15-18H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.21E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50140449 (CHEMBL3754343) Show SMILES Cc1ccc(cc1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C28H35NO3/c1-22-10-12-23(13-11-22)27-21-26(30)25-15-14-24(20-28(25)32-27)31-19-9-5-3-2-4-6-16-29-17-7-8-18-29/h10-15,20-21H,2-9,16-19H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.25E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50140454 (CHEMBL3754412) Show SMILES Oc1ccccc1-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C27H33NO4/c29-24-12-6-5-11-22(24)27-20-25(30)23-14-13-21(19-26(23)32-27)31-18-10-4-2-1-3-7-15-28-16-8-9-17-28/h5-6,11-14,19-20,29H,1-4,7-10,15-18H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of equine serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50200127 (CHEMBL3932576) Show SMILES CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C29H37N3O4/c1-31(2)23-11-9-22(10-12-23)27-20-26(33)25-14-13-24(19-28(25)36-27)35-21-29(34)30-15-5-3-4-6-16-32-17-7-8-18-32/h9-14,19-20H,3-8,15-18,21H2,1-2H3,(H,30,34)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.35E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition by UV-spectrophotometric analysis				Eur J Med Chem 122: 17-26 (2016) Article DOI: 10.1016/j.ejmech.2016.06.022 BindingDB Entry DOI: 10.7270/Q2QZ2CX6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50140563 (CHEMBL3751879) Show SMILES O=c1cc(oc2cc(OCCCCCCCCN3CCCC3)ccc12)-c1ccc(cc1)N1CCCC1 Show InChI InChI=1S/C31H40N2O3/c34-29-24-30(25-11-13-26(14-12-25)33-20-8-9-21-33)36-31-23-27(15-16-28(29)31)35-22-10-4-2-1-3-5-17-32-18-6-7-19-32/h11-16,23-24H,1-10,17-22H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.38E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50200122 (CHEMBL3958981) Show SMILES CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCCCNc3c4CCCCc4nc4ccccc34)cc2o1 Show InChI InChI=1S/C36H38N4O4/c1-40(2)25-15-13-24(14-16-25)33-22-32(41)29-18-17-26(21-34(29)44-33)43-23-35(42)37-19-7-8-20-38-36-27-9-3-5-11-30(27)39-31-12-6-4-10-28(31)36/h3,5,9,11,13-18,21-22H,4,6-8,10,12,19-20,23H2,1-2H3,(H,37,42)(H,38,39)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.46E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition by UV-spectrophotometric analysis				Eur J Med Chem 122: 17-26 (2016) Article DOI: 10.1016/j.ejmech.2016.06.022 BindingDB Entry DOI: 10.7270/Q2QZ2CX6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50140453 (CHEMBL3752142) Show SMILES O=c1cc(oc2cc(OCCCCCCCCN3CCCC3)ccc12)-c1cccc(OCc2ccccc2)c1 Show InChI InChI=1S/C34H39NO4/c36-32-25-33(28-15-12-16-29(23-28)38-26-27-13-6-5-7-14-27)39-34-24-30(17-18-31(32)34)37-22-11-4-2-1-3-8-19-35-20-9-10-21-35/h5-7,12-18,23-25H,1-4,8-11,19-22,26H2	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
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50140545 (CHEMBL3752790) Show SMILES COc1ccc(cc1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C28H35NO4/c1-31-23-12-10-22(11-13-23)27-21-26(30)25-15-14-24(20-28(25)33-27)32-19-9-5-3-2-4-6-16-29-17-7-8-18-29/h10-15,20-21H,2-9,16-19H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM10620 ((S)-3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)...) Show SMILES [H][C@@](C)(N(C)C)c1cccc(OC(=O)N(C)CC)c1 Show InChI InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.71E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of equine serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50140451 (CHEMBL3754264) Show SMILES O=c1cc(oc2cc(OCCCCCCCCN3CCCC3)ccc12)-c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C34H39NO4/c36-32-25-33(28-14-16-29(17-15-28)38-26-27-12-6-5-7-13-27)39-34-24-30(18-19-31(32)34)37-23-11-4-2-1-3-8-20-35-21-9-10-22-35/h5-7,12-19,24-25H,1-4,8-11,20-23,26H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50140449 (CHEMBL3754343) Show SMILES Cc1ccc(cc1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C28H35NO3/c1-22-10-12-23(13-11-22)27-21-26(30)25-15-14-24(20-28(25)32-27)31-19-9-5-3-2-4-6-16-29-17-7-8-18-29/h10-15,20-21H,2-9,16-19H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.92E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of equine serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50140455 (CHEMBL3754649) Show SMILES O=c1cc(oc2cc(OCCCCCCCCN3CCCC3)ccc12)-c1ccccc1OCc1ccccc1 Show InChI InChI=1S/C34H39NO4/c36-31-25-34(30-16-8-9-17-32(30)38-26-27-14-6-5-7-15-27)39-33-24-28(18-19-29(31)33)37-23-13-4-2-1-3-10-20-35-21-11-12-22-35/h5-9,14-19,24-25H,1-4,10-13,20-23,26H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.01E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50140564 (CHEMBL3752109) Show SMILES Brc1ccc(cc1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C27H32BrNO3/c28-22-11-9-21(10-12-22)26-20-25(30)24-14-13-23(19-27(24)32-26)31-18-8-4-2-1-3-5-15-29-16-6-7-17-29/h9-14,19-20H,1-8,15-18H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.15E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50140456 (CHEMBL3754793) Show SMILES COc1cc(cc(OC)c1OC)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C30H39NO6/c1-33-28-18-22(19-29(34-2)30(28)35-3)26-21-25(32)24-13-12-23(20-27(24)37-26)36-17-11-7-5-4-6-8-14-31-15-9-10-16-31/h12-13,18-21H,4-11,14-17H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of equine serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50140560 (CHEMBL3753043) Show SMILES O=c1cc(oc2cc(OCCCCCCCCN3CCCC3)ccc12)-c1ccccc1 Show InChI InChI=1S/C27H33NO3/c29-25-21-26(22-12-6-5-7-13-22)31-27-20-23(14-15-24(25)27)30-19-11-4-2-1-3-8-16-28-17-9-10-18-28/h5-7,12-15,20-21H,1-4,8-11,16-19H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.24E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of equine serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50140547 (CHEMBL3753214) Show SMILES COc1cccc(c1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C28H35NO4/c1-31-23-12-10-11-22(19-23)27-21-26(30)25-14-13-24(20-28(25)33-27)32-18-9-5-3-2-4-6-15-29-16-7-8-17-29/h10-14,19-21H,2-9,15-18H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.29E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of equine serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50200131 (CHEMBL3968969) Show SMILES CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C31H41N3O4/c1-33(2)25-13-11-24(12-14-25)29-22-28(35)27-16-15-26(21-30(27)38-29)37-23-31(36)32-17-7-5-3-4-6-8-18-34-19-9-10-20-34/h11-16,21-22H,3-10,17-20,23H2,1-2H3,(H,32,36)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition by UV-spectrophotometric analysis				Eur J Med Chem 122: 17-26 (2016) Article DOI: 10.1016/j.ejmech.2016.06.022 BindingDB Entry DOI: 10.7270/Q2QZ2CX6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50140454 (CHEMBL3754412) Show SMILES Oc1ccccc1-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C27H33NO4/c29-24-12-6-5-11-22(24)27-20-25(30)23-14-13-21(19-26(23)32-27)31-18-10-4-2-1-3-7-15-28-16-8-9-17-28/h5-6,11-14,19-20,29H,1-4,7-10,15-18H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.07E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50200123 (CHEMBL3913567) Show SMILES CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCN3CCCC3)cc2o1 Show InChI InChI=1S/C25H29N3O4/c1-27(2)19-7-5-18(6-8-19)23-16-22(29)21-10-9-20(15-24(21)32-23)31-17-25(30)26-11-14-28-12-3-4-13-28/h5-10,15-16H,3-4,11-14,17H2,1-2H3,(H,26,30)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.13E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition by UV-spectrophotometric analysis				Eur J Med Chem 122: 17-26 (2016) Article DOI: 10.1016/j.ejmech.2016.06.022 BindingDB Entry DOI: 10.7270/Q2QZ2CX6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50200127 (CHEMBL3932576) Show SMILES CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C29H37N3O4/c1-31(2)23-11-9-22(10-12-23)27-20-26(33)25-14-13-24(19-28(25)36-27)35-21-29(34)30-15-5-3-4-6-16-32-17-7-8-18-32/h9-14,19-20H,3-8,15-18,21H2,1-2H3,(H,30,34)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition by UV-spectrophotometric analysis				Eur J Med Chem 122: 17-26 (2016) Article DOI: 10.1016/j.ejmech.2016.06.022 BindingDB Entry DOI: 10.7270/Q2QZ2CX6
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50140511 (CHEMBL3753742) Show SMILES COc1ccc(cc1OC)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C29H37NO5/c1-32-26-14-11-22(19-29(26)33-2)27-21-25(31)24-13-12-23(20-28(24)35-27)34-18-10-6-4-3-5-7-15-30-16-8-9-17-30/h11-14,19-21H,3-10,15-18H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	3.43E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of equine serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50140565 (CHEMBL3753905) Show SMILES Clc1ccc(cc1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C27H32ClNO3/c28-22-11-9-21(10-12-22)26-20-25(30)24-14-13-23(19-27(24)32-26)31-18-8-4-2-1-3-5-15-29-16-6-7-17-29/h9-14,19-20H,1-8,15-18H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.46E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of equine serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50140563 (CHEMBL3751879) Show SMILES O=c1cc(oc2cc(OCCCCCCCCN3CCCC3)ccc12)-c1ccc(cc1)N1CCCC1 Show InChI InChI=1S/C31H40N2O3/c34-29-24-30(25-11-13-26(14-12-25)33-20-8-9-21-33)36-31-23-27(15-16-28(29)31)35-22-10-4-2-1-3-5-17-32-18-6-7-19-32/h11-16,23-24H,1-10,17-22H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of equine serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50140450 (CHEMBL3754159) Show SMILES Oc1ccc(cc1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C27H33NO4/c29-22-11-9-21(10-12-22)26-20-25(30)24-14-13-23(19-27(24)32-26)31-18-8-4-2-1-3-5-15-28-16-6-7-17-28/h9-14,19-20,29H,1-8,15-18H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.58E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of equine serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50140561 (CHEMBL3753650) Show SMILES O=c1cc(oc2cc(OCCCCCCCCN3CCCC3)ccc12)-c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C33H37NO3/c35-31-25-32(28-16-14-27(15-17-28)26-12-6-5-7-13-26)37-33-24-29(18-19-30(31)33)36-23-11-4-2-1-3-8-20-34-21-9-10-22-34/h5-7,12-19,24-25H,1-4,8-11,20-23H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50200129 (CHEMBL3904577) Show SMILES CN(C)c1ccc(cc1)-c1cc(=O)c2ccc(OCC(=O)NCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C27H33N3O4/c1-29(2)21-9-7-20(8-10-21)25-18-24(31)23-12-11-22(17-26(23)34-25)33-19-27(32)28-13-3-4-14-30-15-5-6-16-30/h7-12,17-18H,3-6,13-16,19H2,1-2H3,(H,28,32)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.83E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using ATC as substrate preincubated for 15 mins followed by substrate addition by UV-spectrophotometric analysis				Eur J Med Chem 122: 17-26 (2016) Article DOI: 10.1016/j.ejmech.2016.06.022 BindingDB Entry DOI: 10.7270/Q2QZ2CX6
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50140452 (CHEMBL3752831) Show SMILES Oc1cccc(c1)-c1cc(=O)c2ccc(OCCCCCCCCN3CCCC3)cc2o1 Show InChI InChI=1S/C27H33NO4/c29-22-11-9-10-21(18-22)26-20-25(30)24-13-12-23(19-27(24)32-26)31-17-8-4-2-1-3-5-14-28-15-6-7-16-28/h9-13,18-20,29H,1-8,14-17H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.92E+3	n/a	n/a	n/a	n/a	n/a	n/a
Henan University Curated by ChEMBL					Assay Description Inhibition of equine serum BChE using BTC as substrate preincubated for 15 mins followed by substrate addition measured at 1 min intervals by Ellman ...				Bioorg Med Chem 24: 672-80 (2016) Article DOI: 10.1016/j.bmc.2015.12.031 BindingDB Entry DOI: 10.7270/Q2ZP4801
					More data for this Ligand-Target Pair

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