Compile Data Set for Download or QSAR

Found 93 hits with Last Name = 'kahnt' and Initial = 'm'   

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
Cholinesterase (Homo sapiens (Human))	BDBM50234795 (CHEMBL4089082) Show SMILES [H][C@]12NCC[C@@]1(C)c1cc(OC(=O)Nc3ccc(cc3)C(C)C)ccc1N2 |r| Show InChI InChI=1S/C21H25N3O2/c1-13(2)14-4-6-15(7-5-14)23-20(25)26-16-8-9-18-17(12-16)21(3)10-11-22-19(21)24-18/h4-9,12-13,19,22,24H,10-11H2,1-3H3,(H,23,25)/t19-,21+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.131	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Inhibition of human serum BChE using butyrylthiocholine iodide as substrate by Ellman's method				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234798 (CHEMBL4091899) Show SMILES [H][C@]1(CC[C@@]2(CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])C(=O)OCc1ccccc1)[C@@H](C)N |r| Show InChI InChI=1S/C38H57NO4/c1-24(39)27-15-20-38(33(41)42-23-26-11-9-8-10-12-26)22-21-36(6)28(32(27)38)13-14-30-35(5)18-17-31(43-25(2)40)34(3,4)29(35)16-19-37(30,36)7/h8-12,24,27-32H,13-23,39H2,1-7H3/t24-,27+,28-,29+,30-,31+,32-,35+,36-,37-,38+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition meas...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234782 (CHEMBL4086293) Show SMILES [H][C@]1(CC[C@@]2(CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])C(=O)OC)[C@@H](C)N |r| Show InChI InChI=1S/C32H53NO4/c1-19(33)21-11-16-32(27(35)36-8)18-17-30(6)22(26(21)32)9-10-24-29(5)14-13-25(37-20(2)34)28(3,4)23(29)12-15-31(24,30)7/h19,21-26H,9-18,33H2,1-8H3/t19-,21+,22-,23+,24-,25+,26-,29+,30-,31-,32+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	50	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Uncompetitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition me...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234803 (CHEMBL4099629) Show SMILES [H][C@]1(CC[C@]2(COC(C)=O)CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])[C@@H](C)N |r| Show InChI InChI=1S/C33H55NO4/c1-20(34)23-11-16-33(19-37-21(2)35)18-17-31(7)24(28(23)33)9-10-26-30(6)14-13-27(38-22(3)36)29(4,5)25(30)12-15-32(26,31)8/h20,23-28H,9-19,34H2,1-8H3/t20-,23+,24-,25+,26-,27+,28-,30+,31-,32-,33-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition meas...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234800 (CHEMBL4084140) Show SMILES [H][C@]1(CC[C@@]2(CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])C(=O)OCc1ccccc1)[C@@H](C)N |r| Show InChI InChI=1S/C36H55NO3/c1-23(37)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(38)32(2,3)27(33)15-18-35(28,34)6/h7-11,23,25-30,38H,12-22,37H2,1-6H3/t23-,25+,26-,27+,28-,29+,30-,33+,34-,35-,36+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition meas...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50234796 (CHEMBL4071069) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](OC(C)=O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)OCc1ccccc1)C(C)=O |r| Show InChI InChI=1S/C38H54O5/c1-24(39)27-15-20-38(33(41)42-23-26-11-9-8-10-12-26)22-21-36(6)28(32(27)38)13-14-30-35(5)18-17-31(43-25(2)40)34(3,4)29(35)16-19-37(30,36)7/h8-12,27-32H,13-23H2,1-7H3/t27-,28+,29-,30+,31-,32+,35-,36+,37+,38-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition measu...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234782 (CHEMBL4086293) Show SMILES [H][C@]1(CC[C@@]2(CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])C(=O)OC)[C@@H](C)N |r| Show InChI InChI=1S/C32H53NO4/c1-19(33)21-11-16-32(27(35)36-8)18-17-30(6)22(26(21)32)9-10-24-29(5)14-13-25(37-20(2)34)28(3,4)23(29)12-15-31(24,30)7/h19,21-26H,9-18,33H2,1-8H3/t19-,21+,22-,23+,24-,25+,26-,29+,30-,31-,32+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition meas...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234799 (CHEMBL4096275) Show SMILES [H][C@]1(CC[C@@]2(CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])C(O)=O)[C@@H](C)N |r| Show InChI InChI=1S/C31H51NO4/c1-18(32)20-10-15-31(26(34)35)17-16-29(6)21(25(20)31)8-9-23-28(5)13-12-24(36-19(2)33)27(3,4)22(28)11-14-30(23,29)7/h18,20-25H,8-17,32H2,1-7H3,(H,34,35)/t18-,20+,21-,22+,23-,24+,25-,28+,29-,30-,31+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition meas...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234780 (CHEMBL4081627) Show SMILES [H][C@]1(CC[C@]2(CO)CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])[C@@H](C)N |r| Show InChI InChI=1S/C29H51NO2/c1-18(30)19-9-14-29(17-31)16-15-27(5)20(24(19)29)7-8-22-26(4)12-11-23(32)25(2,3)21(26)10-13-28(22,27)6/h18-24,31-32H,7-17,30H2,1-6H3/t18-,19+,20-,21+,22-,23+,24-,26+,27-,28-,29-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	140	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition meas...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234800 (CHEMBL4084140) Show SMILES [H][C@]1(CC[C@@]2(CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])C(=O)OCc1ccccc1)[C@@H](C)N |r| Show InChI InChI=1S/C36H55NO3/c1-23(37)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(38)32(2,3)27(33)15-18-35(28,34)6/h7-11,23,25-30,38H,12-22,37H2,1-6H3/t23-,25+,26-,27+,28-,29+,30-,33+,34-,35-,36+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	190	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Uncompetitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition me...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50234796 (CHEMBL4071069) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](OC(C)=O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)OCc1ccccc1)C(C)=O |r| Show InChI InChI=1S/C38H54O5/c1-24(39)27-15-20-38(33(41)42-23-26-11-9-8-10-12-26)22-21-36(6)28(32(27)38)13-14-30-35(5)18-17-31(43-25(2)40)34(3,4)29(35)16-19-37(30,36)7/h8-12,27-32H,13-23H2,1-7H3/t27-,28+,29-,30+,31-,32+,35-,36+,37+,38-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	210	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Uncompetitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition mea...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234783 (CHEMBL4104205) Show SMILES [H][C@]1(CC[C@@]2(CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])C(=O)OC)[C@H](C)N |r| Show InChI InChI=1S/C32H53NO4/c1-19(33)21-11-16-32(27(35)36-8)18-17-30(6)22(26(21)32)9-10-24-29(5)14-13-25(37-20(2)34)28(3,4)23(29)12-15-31(24,30)7/h19,21-26H,9-18,33H2,1-8H3/t19-,21-,22+,23-,24+,25-,26+,29-,30+,31+,32-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	230	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition meas...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234803 (CHEMBL4099629) Show SMILES [H][C@]1(CC[C@]2(COC(C)=O)CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])[C@@H](C)N |r| Show InChI InChI=1S/C33H55NO4/c1-20(34)23-11-16-33(19-37-21(2)35)18-17-31(7)24(28(23)33)9-10-26-30(6)14-13-27(38-22(3)36)29(4,5)25(30)12-15-32(26,31)8/h20,23-28H,9-19,34H2,1-8H3/t20-,23+,24-,25+,26-,27+,28-,30+,31-,32-,33-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	370	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Uncompetitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition me...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234797 (CHEMBL4062429) Show SMILES [H][C@]1(CC[C@@]2(CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])C(=O)OCc1ccccc1)[C@H](C)N |r| Show InChI InChI=1S/C38H57NO4/c1-24(39)27-15-20-38(33(41)42-23-26-11-9-8-10-12-26)22-21-36(6)28(32(27)38)13-14-30-35(5)18-17-31(43-25(2)40)34(3,4)29(35)16-19-37(30,36)7/h8-12,24,27-32H,13-23,39H2,1-7H3/t24-,27-,28+,29-,30+,31-,32+,35-,36+,37+,38-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	380	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition meas...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234798 (CHEMBL4091899) Show SMILES [H][C@]1(CC[C@@]2(CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])C(=O)OCc1ccccc1)[C@@H](C)N |r| Show InChI InChI=1S/C38H57NO4/c1-24(39)27-15-20-38(33(41)42-23-26-11-9-8-10-12-26)22-21-36(6)28(32(27)38)13-14-30-35(5)18-17-31(43-25(2)40)34(3,4)29(35)16-19-37(30,36)7/h8-12,24,27-32H,13-23,39H2,1-7H3/t24-,27+,28-,29+,30-,31+,32-,35+,36-,37-,38+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Uncompetitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition me...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM10404 ((1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetrac...) Show SMILES COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 |r,c:12| Show InChI InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition measu...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234787 (CHEMBL4072365) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](N)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)OCc1ccccc1)C(C)=O |r| Show InChI InChI=1S/C36H53NO3/c1-23(38)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(37)32(2,3)27(33)15-18-35(28,34)6/h7-11,25-30H,12-22,37H2,1-6H3/t25-,26+,27-,28+,29-,30+,33-,34+,35+,36-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	560	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition meas...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50234789 (CHEMBL4063629) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)OCc1ccccc1)C(C)=O |r| Show InChI InChI=1S/C36H52O4/c1-23(37)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(38)32(2,3)27(33)15-18-35(28,34)6/h7-11,25-30,38H,12-22H2,1-6H3/t25-,26+,27-,28+,29-,30+,33-,34+,35+,36-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	590	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition measu...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50058819 (CHEMBL3325723) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)OC)C(C)=O |r| Show InChI InChI=1S/C30H48O4/c1-18(31)19-10-15-30(25(33)34-7)17-16-28(5)20(24(19)30)8-9-22-27(4)13-12-23(32)26(2,3)21(27)11-14-29(22,28)6/h19-24,32H,8-17H2,1-7H3/t19-,20+,21-,22+,23-,24+,27-,28+,29+,30-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	760	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition measu...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234788 (CHEMBL4093124) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@@H](N)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)OCc1ccccc1)C(C)=O |r| Show InChI InChI=1S/C36H53NO3/c1-23(38)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(37)32(2,3)27(33)15-18-35(28,34)6/h7-11,25-30H,12-22,37H2,1-6H3/t25-,26+,27-,28+,29+,30+,33-,34+,35+,36-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition meas...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234780 (CHEMBL4081627) Show SMILES [H][C@]1(CC[C@]2(CO)CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])[C@@H](C)N |r| Show InChI InChI=1S/C29H51NO2/c1-18(30)19-9-14-29(17-31)16-15-27(5)20(24(19)29)7-8-22-26(4)12-11-23(32)25(2,3)21(26)10-13-28(22,27)6/h18-24,31-32H,7-17,30H2,1-6H3/t18-,19+,20-,21+,22-,23+,24-,26+,27-,28-,29-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.89E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Uncompetitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition me...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50234802 (CHEMBL4085251) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CCC(=O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)OCc1ccccc1)C(C)=O |r| Show InChI InChI=1S/C36H50O4/c1-23(37)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(38)32(2,3)27(33)15-18-35(28,34)6/h7-11,25-28,30H,12-22H2,1-6H3/t25-,26+,27-,28+,30+,33-,34+,35+,36-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.63E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition measu...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234799 (CHEMBL4096275) Show SMILES [H][C@]1(CC[C@@]2(CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])C(O)=O)[C@@H](C)N |r| Show InChI InChI=1S/C31H51NO4/c1-18(32)20-10-15-31(26(34)35)17-16-29(6)21(25(20)31)8-9-23-28(5)13-12-24(36-19(2)33)27(3,4)22(28)11-14-30(23,29)7/h18,20-25H,8-17,32H2,1-7H3,(H,34,35)/t18-,20+,21-,22+,23-,24+,25-,28+,29-,30-,31+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.75E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Uncompetitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition me...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50234792 (CHEMBL4100709) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](OC(C)=O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)NCCN)C(C)=O |r| Show InChI InChI=1S/C33H54N2O4/c1-20(36)22-10-15-33(28(38)35-19-18-34)17-16-31(6)23(27(22)33)8-9-25-30(5)13-12-26(39-21(2)37)29(3,4)24(30)11-14-32(25,31)7/h22-27H,8-19,34H2,1-7H3,(H,35,38)/t22-,23+,24-,25+,26-,27+,30-,31+,32+,33-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.06E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition measu...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234787 (CHEMBL4072365) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](N)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)OCc1ccccc1)C(C)=O |r| Show InChI InChI=1S/C36H53NO3/c1-23(38)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(37)32(2,3)27(33)15-18-35(28,34)6/h7-11,25-30H,12-22,37H2,1-6H3/t25-,26+,27-,28+,29-,30+,33-,34+,35+,36-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	3.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Uncompetitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition me...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234783 (CHEMBL4104205) Show SMILES [H][C@]1(CC[C@@]2(CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])C(=O)OC)[C@H](C)N |r| Show InChI InChI=1S/C32H53NO4/c1-19(33)21-11-16-32(27(35)36-8)18-17-30(6)22(26(21)32)9-10-24-29(5)14-13-25(37-20(2)34)28(3,4)23(29)12-15-31(24,30)7/h19,21-26H,9-18,33H2,1-8H3/t19-,21-,22+,23-,24+,25-,26+,29-,30+,31+,32-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.89E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Uncompetitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition me...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50058819 (CHEMBL3325723) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)OC)C(C)=O |r| Show InChI InChI=1S/C30H48O4/c1-18(31)19-10-15-30(25(33)34-7)17-16-28(5)20(24(19)30)8-9-22-27(4)13-12-23(32)26(2,3)21(27)11-14-29(22,28)6/h19-24,32H,8-17H2,1-7H3/t19-,20+,21-,22+,23-,24+,27-,28+,29+,30-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition meas...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50234781 (CHEMBL4061347) Show SMILES [H][C@]1(CC[C@@]2(CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])C(=O)OC)[C@@H](C)NC(C)=O |r| Show InChI InChI=1S/C34H55NO5/c1-20(35-21(2)36)23-12-17-34(29(38)39-9)19-18-32(7)24(28(23)34)10-11-26-31(6)15-14-27(40-22(3)37)30(4,5)25(31)13-16-33(26,32)8/h20,23-28H,10-19H2,1-9H3,(H,35,36)/t20-,23+,24-,25+,26-,27+,28-,31+,32-,33-,34+/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition measu...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50234782 (CHEMBL4086293) Show SMILES [H][C@]1(CC[C@@]2(CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])C(=O)OC)[C@@H](C)N |r| Show InChI InChI=1S/C32H53NO4/c1-19(33)21-11-16-32(27(35)36-8)18-17-30(6)22(26(21)32)9-10-24-29(5)14-13-25(37-20(2)34)28(3,4)23(29)12-15-31(24,30)7/h19,21-26H,9-18,33H2,1-8H3/t19-,21+,22-,23+,24-,25+,26-,29+,30-,31-,32+/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition measu...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234781 (CHEMBL4061347) Show SMILES [H][C@]1(CC[C@@]2(CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])C(=O)OC)[C@@H](C)NC(C)=O |r| Show InChI InChI=1S/C34H55NO5/c1-20(35-21(2)36)23-12-17-34(29(38)39-9)19-18-32(7)24(28(23)34)10-11-26-31(6)15-14-27(40-22(3)37)30(4,5)25(31)13-16-33(26,32)8/h20,23-28H,10-19H2,1-9H3,(H,35,36)/t20-,23+,24-,25+,26-,27+,28-,31+,32-,33-,34+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition meas...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50234789 (CHEMBL4063629) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)OCc1ccccc1)C(C)=O |r| Show InChI InChI=1S/C36H52O4/c1-23(37)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(38)32(2,3)27(33)15-18-35(28,34)6/h7-11,25-30,38H,12-22H2,1-6H3/t25-,26+,27-,28+,29-,30+,33-,34+,35+,36-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.06E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Uncompetitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition mea...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM10404 ((1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetrac...) Show SMILES COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 |r,c:12| Show InChI InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	4.24E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition meas...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50234803 (CHEMBL4099629) Show SMILES [H][C@]1(CC[C@]2(COC(C)=O)CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])[C@@H](C)N |r| Show InChI InChI=1S/C33H55NO4/c1-20(34)23-11-16-33(19-37-21(2)35)18-17-31(7)24(28(23)33)9-10-26-30(6)14-13-27(38-22(3)36)29(4,5)25(30)12-15-32(26,31)8/h20,23-28H,9-19,34H2,1-8H3/t20-,23+,24-,25+,26-,27+,28-,30+,31-,32-,33-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition measu...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50234802 (CHEMBL4085251) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CCC(=O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)OCc1ccccc1)C(C)=O |r| Show InChI InChI=1S/C36H50O4/c1-23(37)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(38)32(2,3)27(33)15-18-35(28,34)6/h7-11,25-28,30H,12-22H2,1-6H3/t25-,26+,27-,28+,30+,33-,34+,35+,36-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.59E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Uncompetitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition mea...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234788 (CHEMBL4093124) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@@H](N)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)OCc1ccccc1)C(C)=O |r| Show InChI InChI=1S/C36H53NO3/c1-23(38)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(37)32(2,3)27(33)15-18-35(28,34)6/h7-11,25-30H,12-22,37H2,1-6H3/t25-,26+,27-,28+,29+,30+,33-,34+,35+,36-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.98E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Uncompetitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition me...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234791 (CHEMBL4062563) Show SMILES [H][C@]12[C@@H](CC[C@]1(N)CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C)C(C)=O |r| Show InChI InChI=1S/C28H47NO2/c1-17(30)18-9-14-28(29)16-15-26(5)19(23(18)28)7-8-21-25(4)12-11-22(31)24(2,3)20(25)10-13-27(21,26)6/h18-23,31H,7-16,29H2,1-6H3/t18-,19+,20-,21+,22-,23+,25-,26+,27+,28-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.39E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition meas...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50234786 (CHEMBL4075135) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](OC(C)=O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)OC)C(\C)=N/O |r| Show InChI InChI=1S/C32H51NO5/c1-19(33-36)21-11-16-32(27(35)37-8)18-17-30(6)22(26(21)32)9-10-24-29(5)14-13-25(38-20(2)34)28(3,4)23(29)12-15-31(24,30)7/h21-26,36H,9-18H2,1-8H3/b33-19-/t21-,22+,23-,24+,25-,26+,29-,30+,31+,32-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	6.51E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition measu...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234797 (CHEMBL4062429) Show SMILES [H][C@]1(CC[C@@]2(CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])C(=O)OCc1ccccc1)[C@H](C)N |r| Show InChI InChI=1S/C38H57NO4/c1-24(39)27-15-20-38(33(41)42-23-26-11-9-8-10-12-26)22-21-36(6)28(32(27)38)13-14-30-35(5)18-17-31(43-25(2)40)34(3,4)29(35)16-19-37(30,36)7/h8-12,24,27-32H,13-23,39H2,1-7H3/t24-,27-,28+,29-,30+,31-,32+,35-,36+,37+,38-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.78E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Uncompetitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition me...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50234792 (CHEMBL4100709) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](OC(C)=O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)NCCN)C(C)=O |r| Show InChI InChI=1S/C33H54N2O4/c1-20(36)22-10-15-33(28(38)35-19-18-34)17-16-31(6)23(27(22)33)8-9-25-30(5)13-12-26(39-21(2)37)29(3,4)24(30)11-14-32(25,31)7/h22-27H,8-19,34H2,1-7H3,(H,35,38)/t22-,23+,24-,25+,26-,27+,30-,31+,32+,33-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.83E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Uncompetitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition mea...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50234805 (CHEMBL4063777) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](OC(C)=O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)OC)C(\C)=N\O |r| Show InChI InChI=1S/C32H51NO5/c1-19(33-36)21-11-16-32(27(35)37-8)18-17-30(6)22(26(21)32)9-10-24-29(5)14-13-25(38-20(2)34)28(3,4)23(29)12-15-31(24,30)7/h21-26,36H,9-18H2,1-8H3/b33-19+/t21-,22+,23-,24+,25-,26+,29-,30+,31+,32-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.96E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition measu...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50234779 (CHEMBL4090532) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)NCCN)C(C)=O |r| Show InChI InChI=1S/C31H52N2O3/c1-19(34)20-9-14-31(26(36)33-18-17-32)16-15-29(5)21(25(20)31)7-8-23-28(4)12-11-24(35)27(2,3)22(28)10-13-30(23,29)6/h20-25,35H,7-18,32H2,1-6H3,(H,33,36)/t20-,21+,22-,23+,24-,25+,28-,29+,30+,31-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.18E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition measu...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50234793 (CHEMBL4082718) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](OC(C)=O)C(C)(C)[C@]3([H])CC[C@@]12C)C(N)=O)C(C)=O |r| Show InChI InChI=1S/C31H49NO4/c1-18(33)20-10-15-31(26(32)35)17-16-29(6)21(25(20)31)8-9-23-28(5)13-12-24(36-19(2)34)27(3,4)22(28)11-14-30(23,29)7/h20-25H,8-17H2,1-7H3,(H2,32,35)/t20-,21+,22-,23+,24-,25+,28-,29+,30+,31-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	8.16E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition measu...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234779 (CHEMBL4090532) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)NCCN)C(C)=O |r| Show InChI InChI=1S/C31H52N2O3/c1-19(34)20-9-14-31(26(36)33-18-17-32)16-15-29(5)21(25(20)31)7-8-23-28(4)12-11-24(35)27(2,3)22(28)10-13-30(23,29)6/h20-25,35H,7-18,32H2,1-6H3,(H,33,36)/t20-,21+,22-,23+,24-,25+,28-,29+,30+,31-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.37E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition meas...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50234798 (CHEMBL4091899) Show SMILES [H][C@]1(CC[C@@]2(CC[C@]3(C)[C@]([H])(CC[C@]4([H])[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@]5([H])CC[C@@]34C)[C@@]12[H])C(=O)OCc1ccccc1)[C@@H](C)N |r| Show InChI InChI=1S/C38H57NO4/c1-24(39)27-15-20-38(33(41)42-23-26-11-9-8-10-12-26)22-21-36(6)28(32(27)38)13-14-30-35(5)18-17-31(43-25(2)40)34(3,4)29(35)16-19-37(30,36)7/h8-12,24,27-32H,13-23,39H2,1-7H3/t24-,27+,28-,29+,30-,31+,32-,35+,36-,37-,38+/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.51E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition measu...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50234794 (CHEMBL4081749) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](OC(C)=O)C(C)(C)[C@]3([H])CC[C@@]12C)C(O)=O)C(C)=O |r| Show InChI InChI=1S/C31H48O5/c1-18(32)20-10-15-31(26(34)35)17-16-29(6)21(25(20)31)8-9-23-28(5)13-12-24(36-19(2)33)27(3,4)22(28)11-14-30(23,29)7/h20-25H,8-17H2,1-7H3,(H,34,35)/t20-,21+,22-,23+,24-,25+,28-,29+,30+,31-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition measu...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50234779 (CHEMBL4090532) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)NCCN)C(C)=O |r| Show InChI InChI=1S/C31H52N2O3/c1-19(34)20-9-14-31(26(36)33-18-17-32)16-15-29(5)21(25(20)31)7-8-23-28(4)12-11-24(35)27(2,3)22(28)10-13-30(23,29)6/h20-25,35H,7-18,32H2,1-6H3,(H,33,36)/t20-,21+,22-,23+,24-,25+,28-,29+,30+,31-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.71E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Uncompetitive inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition mea...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234805 (CHEMBL4063777) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](OC(C)=O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)OC)C(\C)=N\O |r| Show InChI InChI=1S/C32H51NO5/c1-19(33-36)21-11-16-32(27(35)37-8)18-17-30(6)22(26(21)32)9-10-24-29(5)14-13-25(38-20(2)34)28(3,4)23(29)12-15-31(24,30)7/h21-26,36H,9-18H2,1-8H3/b33-19+/t21-,22+,23-,24+,25-,26+,29-,30+,31+,32-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition meas...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234793 (CHEMBL4082718) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](OC(C)=O)C(C)(C)[C@]3([H])CC[C@@]12C)C(N)=O)C(C)=O |r| Show InChI InChI=1S/C31H49NO4/c1-18(33)20-10-15-31(26(32)35)17-16-29(6)21(25(20)31)8-9-23-28(5)13-12-24(36-19(2)34)27(3,4)22(28)11-14-30(23,29)7/h20-25H,8-17H2,1-7H3,(H2,32,35)/t20-,21+,22-,23+,24-,25+,28-,29+,30+,31-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition meas...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234789 (CHEMBL4063629) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)OCc1ccccc1)C(C)=O |r| Show InChI InChI=1S/C36H52O4/c1-23(37)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(38)32(2,3)27(33)15-18-35(28,34)6/h7-11,25-30,38H,12-22H2,1-6H3/t25-,26+,27-,28+,29-,30+,33-,34+,35+,36-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition meas...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50234802 (CHEMBL4085251) Show SMILES [H][C@]12[C@@H](CC[C@@]1(CC[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CCC(=O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)OCc1ccccc1)C(C)=O |r| Show InChI InChI=1S/C36H50O4/c1-23(37)25-14-19-36(31(39)40-22-24-10-8-7-9-11-24)21-20-34(5)26(30(25)36)12-13-28-33(4)17-16-29(38)32(2,3)27(33)15-18-35(28,34)6/h7-11,25-28,30H,12-22H2,1-6H3/t25-,26+,27-,28+,30+,33-,34+,35+,36-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Martin-Luther University Halle-Wittenberg Curated by ChEMBL					Assay Description Competitive inhibition of equine serum BChE using butyrylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition meas...				Eur J Med Chem 126: 652-668 (2017) Article DOI: 10.1016/j.ejmech.2016.11.056 BindingDB Entry DOI: 10.7270/Q2X0698K
					More data for this Ligand-Target Pair

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