Compile Data Set for Download or QSAR

Found 32 hits with Last Name = 'de andrade ramos' and Initial = 'g'   

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))	BDBM50139050 (CHEMBL3753906) Show SMILES COc1cccc(CCCCCCCCN2CCC(C2)OC(=O)N(C)C)c1 Show InChI InChI=1S/C22H36N2O3/c1-23(2)22(25)27-21-14-16-24(18-21)15-9-7-5-4-6-8-11-19-12-10-13-20(17-19)26-3/h10,12-13,17,21H,4-9,11,14-16,18H2,1-3H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Non-competitive inhibition of electric eel acetylcholine esterase using acetylcholine iodide as substrate by Ellman's method				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50139006 (CHEMBL3753607) Show SMILES CCN(CCCCCCCCc1cccc(OC)c1)Cc1ccccc1 Show InChI InChI=1S/C24H35NO/c1-3-25(21-23-15-10-8-11-16-23)19-12-7-5-4-6-9-14-22-17-13-18-24(20-22)26-2/h8,10-11,13,15-18,20H,3-7,9,12,14,19,21H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.04E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Non-competitive inhibition of electric eel acetylcholine esterase using acetylcholine iodide as substrate by Ellman's method				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50139052 (CHEMBL3754700) Show SMILES COc1cccc(CCCCCCCCNCc2ccccc2OC)c1 Show InChI InChI=1S/C23H33NO2/c1-25-22-15-11-13-20(18-22)12-7-5-3-4-6-10-17-24-19-21-14-8-9-16-23(21)26-2/h8-9,11,13-16,18,24H,3-7,10,12,17,19H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.70E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Non-competitive inhibition of electric eel acetylcholine esterase using acetylcholine iodide as substrate by Ellman's method				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50139049 (CHEMBL3753732) Show SMILES COc1cccc(CCCCCCCCN2CCCC(C2)OC(C)=O)c1 Show InChI InChI=1S/C22H35NO3/c1-19(24)26-22-14-10-16-23(18-22)15-8-6-4-3-5-7-11-20-12-9-13-21(17-20)25-2/h9,12-13,17,22H,3-8,10-11,14-16,18H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.90E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Non-competitive inhibition of electric eel acetylcholine esterase using acetylcholine iodide as substrate by Ellman's method				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50139051 (CHEMBL3753070) Show SMILES COc1cccc(CCCCCCCCN2CCCC(C2)OC(=O)N(C)C)c1 Show InChI InChI=1S/C23H38N2O3/c1-24(2)23(26)28-22-15-11-17-25(19-22)16-9-7-5-4-6-8-12-20-13-10-14-21(18-20)27-3/h10,13-14,18,22H,4-9,11-12,15-17,19H2,1-3H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.24E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Non-competitive inhibition of electric eel acetylcholine esterase using acetylcholine iodide as substrate by Ellman's method				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50139007 (CHEMBL3754287) Show SMILES COc1cccc(CCCCCCCCN2CCCC2)c1 Show InChI InChI=1S/C19H31NO/c1-21-19-13-10-12-18(17-19)11-6-4-2-3-5-7-14-20-15-8-9-16-20/h10,12-13,17H,2-9,11,14-16H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.24E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Mixed inhibition of electric eel acetylcholine esterase using acetylcholine iodide as substrate by Ellman's method				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50139053 (CHEMBL3752227) Show SMILES CCN(CCCCCCCCc1cccc(OC)c1)Cc1ccccc1OC Show InChI InChI=1S/C25H37NO2/c1-4-26(21-23-16-10-11-18-25(23)28-3)19-12-8-6-5-7-9-14-22-15-13-17-24(20-22)27-2/h10-11,13,15-18,20H,4-9,12,14,19,21H2,1-3H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.44E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Non-competitive inhibition of electric eel acetylcholine esterase using acetylcholine iodide as substrate by Ellman's method				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	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 MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB Article PubMed	n/a	n/a	2.01E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Inhibition of human acetylcholine esterase preincubated for 10 mins followed by the addition of 550 uM of acetylcholine iodide as substrate measured ...				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair				3D Structure (crystal)
Cholinesterase (Equus caballus (Horse))	BDBM50139052 (CHEMBL3754700) Show SMILES COc1cccc(CCCCCCCCNCc2ccccc2OC)c1 Show InChI InChI=1S/C23H33NO2/c1-25-22-15-11-13-20(18-22)12-7-5-3-4-6-10-17-24-19-21-14-8-9-16-23(21)26-2/h8-9,11,13-16,18,24H,3-7,10,12,17,19H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Inhibition of horse butyrylcholine esterase preincubated for 10 mins followed by the addition of butyrylcholine iodide as substrate measured after 5 ...				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50597595 (CHEMBL5190179) Show SMILES OCCCCCCCCc1ccc(CN2CCCCCC2)c(O)c1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.62E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1039/d1md00046b BindingDB Entry DOI: 10.7270/Q2WM1JG5
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50139053 (CHEMBL3752227) Show SMILES CCN(CCCCCCCCc1cccc(OC)c1)Cc1ccccc1OC Show InChI InChI=1S/C25H37NO2/c1-4-26(21-23-16-10-11-18-25(23)28-3)19-12-8-6-5-7-9-14-22-15-13-17-24(20-22)27-2/h10-11,13,15-18,20H,4-9,12,14,19,21H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Inhibition of horse butyrylcholine esterase preincubated for 10 mins followed by the addition of butyrylcholine iodide as substrate measured after 5 ...				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50139053 (CHEMBL3752227) Show SMILES CCN(CCCCCCCCc1cccc(OC)c1)Cc1ccccc1OC Show InChI InChI=1S/C25H37NO2/c1-4-26(21-23-16-10-11-18-25(23)28-3)19-12-8-6-5-7-9-14-22-15-13-17-24(20-22)27-2/h10-11,13,15-18,20H,4-9,12,14,19,21H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.65E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1039/d1md00046b BindingDB Entry DOI: 10.7270/Q2WM1JG5
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50139053 (CHEMBL3752227) Show SMILES CCN(CCCCCCCCc1cccc(OC)c1)Cc1ccccc1OC Show InChI InChI=1S/C25H37NO2/c1-4-26(21-23-16-10-11-18-25(23)28-3)19-12-8-6-5-7-9-14-22-15-13-17-24(20-22)27-2/h10-11,13,15-18,20H,4-9,12,14,19,21H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.65E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Inhibition of human acetylcholine esterase preincubated for 10 mins followed by the addition of 550 uM of acetylcholine iodide as substrate measured ...				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50597594 (CHEMBL5183866) Show SMILES OCCCCCCCCc1ccc(CN2CCCCC2)c(O)c1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.12E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1039/d1md00046b BindingDB Entry DOI: 10.7270/Q2WM1JG5
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50139053 (CHEMBL3752227) Show SMILES CCN(CCCCCCCCc1cccc(OC)c1)Cc1ccccc1OC Show InChI InChI=1S/C25H37NO2/c1-4-26(21-23-16-10-11-18-25(23)28-3)19-12-8-6-5-7-9-14-22-15-13-17-24(20-22)27-2/h10-11,13,15-18,20H,4-9,12,14,19,21H2,1-3H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Inhibition of electric eel acetylcholine esterase preincubated for 10 mins followed by the addition of acetylcholine iodide as substrate measured aft...				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50597596 (CHEMBL5195029) Show SMILES CN(Cc1ccccc1)Cc1ccc(CCCCCCCCO)cc1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.74E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1039/d1md00046b BindingDB Entry DOI: 10.7270/Q2WM1JG5
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50139006 (CHEMBL3753607) Show SMILES CCN(CCCCCCCCc1cccc(OC)c1)Cc1ccccc1 Show InChI InChI=1S/C24H35NO/c1-3-25(21-23-15-10-8-11-16-23)19-12-7-5-4-6-9-14-22-17-13-18-24(20-22)26-2/h8,10-11,13,15-18,20H,3-7,9,12,14,19,21H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Inhibition of horse butyrylcholine esterase preincubated for 10 mins followed by the addition of butyrylcholine iodide as substrate measured after 5 ...				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50597593 (CHEMBL5192958) Show SMILES OCCCCCCCCc1ccc(CN2CCCC2)c(O)c1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.33E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1039/d1md00046b BindingDB Entry DOI: 10.7270/Q2WM1JG5
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50139050 (CHEMBL3753906) Show SMILES COc1cccc(CCCCCCCCN2CCC(C2)OC(=O)N(C)C)c1 Show InChI InChI=1S/C22H36N2O3/c1-23(2)22(25)27-21-14-16-24(18-21)15-9-7-5-4-6-8-11-19-12-10-13-20(17-19)26-3/h10,12-13,17,21H,4-9,11,14-16,18H2,1-3H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.37E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Inhibition of electric eel acetylcholine esterase preincubated for 10 mins followed by the addition of acetylcholine iodide as substrate measured aft...				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50139051 (CHEMBL3753070) Show SMILES COc1cccc(CCCCCCCCN2CCCC(C2)OC(=O)N(C)C)c1 Show InChI InChI=1S/C23H38N2O3/c1-24(2)23(26)28-22-15-11-17-25(19-22)16-9-7-5-4-6-8-12-20-13-10-14-21(18-20)27-3/h10,13-14,18,22H,4-9,11-12,15-17,19H2,1-3H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.43E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Inhibition of electric eel acetylcholine esterase preincubated for 10 mins followed by the addition of acetylcholine iodide as substrate measured aft...				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50139049 (CHEMBL3753732) Show SMILES COc1cccc(CCCCCCCCN2CCCC(C2)OC(C)=O)c1 Show InChI InChI=1S/C22H35NO3/c1-19(24)26-22-14-10-16-23(18-22)15-8-6-4-3-5-7-11-20-12-9-13-21(17-20)25-2/h9,12-13,17,22H,3-8,10-11,14-16,18H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.61E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Inhibition of electric eel acetylcholine esterase preincubated for 10 mins followed by the addition of acetylcholine iodide as substrate measured aft...				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50139006 (CHEMBL3753607) Show SMILES CCN(CCCCCCCCc1cccc(OC)c1)Cc1ccccc1 Show InChI InChI=1S/C24H35NO/c1-3-25(21-23-15-10-8-11-16-23)19-12-7-5-4-6-9-14-22-17-13-18-24(20-22)26-2/h8,10-11,13,15-18,20H,3-7,9,12,14,19,21H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.61E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Inhibition of electric eel acetylcholine esterase preincubated for 10 mins followed by the addition of acetylcholine iodide as substrate measured aft...				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50139007 (CHEMBL3754287) Show SMILES COc1cccc(CCCCCCCCN2CCCC2)c1 Show InChI InChI=1S/C19H31NO/c1-21-19-13-10-12-18(17-19)11-6-4-2-3-5-7-14-20-15-8-9-16-20/h10,12-13,17H,2-9,11,14-16H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.64E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Inhibition of horse butyrylcholine esterase preincubated for 10 mins followed by the addition of butyrylcholine iodide as substrate measured after 5 ...				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50139052 (CHEMBL3754700) Show SMILES COc1cccc(CCCCCCCCNCc2ccccc2OC)c1 Show InChI InChI=1S/C23H33NO2/c1-25-22-15-11-13-20(18-22)12-7-5-3-4-6-10-17-24-19-21-14-8-9-16-23(21)26-2/h8-9,11,13-16,18,24H,3-7,10,12,17,19H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.72E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Inhibition of electric eel acetylcholine esterase preincubated for 10 mins followed by the addition of acetylcholine iodide as substrate measured aft...				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50597597 (CHEMBL5176423) Show SMILES CCN(CC)Cc1ccc(CCCCCCCCO)cc1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.75E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1039/d1md00046b BindingDB Entry DOI: 10.7270/Q2WM1JG5
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50139049 (CHEMBL3753732) Show SMILES COc1cccc(CCCCCCCCN2CCCC(C2)OC(C)=O)c1 Show InChI InChI=1S/C22H35NO3/c1-19(24)26-22-14-10-16-23(18-22)15-8-6-4-3-5-7-11-20-12-9-13-21(17-20)25-2/h9,12-13,17,22H,3-8,10-11,14-16,18H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Inhibition of horse butyrylcholine esterase preincubated for 10 mins followed by the addition of butyrylcholine iodide as substrate measured after 5 ...				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50139007 (CHEMBL3754287) Show SMILES COc1cccc(CCCCCCCCN2CCCC2)c1 Show InChI InChI=1S/C19H31NO/c1-21-19-13-10-12-18(17-19)11-6-4-2-3-5-7-14-20-15-8-9-16-20/h10,12-13,17H,2-9,11,14-16H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.96E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Inhibition of electric eel acetylcholine esterase preincubated for 10 mins followed by the addition of acetylcholine iodide as substrate measured aft...				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50139050 (CHEMBL3753906) Show SMILES COc1cccc(CCCCCCCCN2CCC(C2)OC(=O)N(C)C)c1 Show InChI InChI=1S/C22H36N2O3/c1-23(2)22(25)27-21-14-16-24(18-21)15-9-7-5-4-6-8-11-19-12-10-13-20(17-19)26-3/h10,12-13,17,21H,4-9,11,14-16,18H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.28E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Inhibition of horse butyrylcholine esterase preincubated for 10 mins followed by the addition of butyrylcholine iodide as substrate measured after 5 ...				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50139051 (CHEMBL3753070) Show SMILES COc1cccc(CCCCCCCCN2CCCC(C2)OC(=O)N(C)C)c1 Show InChI InChI=1S/C23H38N2O3/c1-24(2)23(26)28-22-15-11-17-25(19-22)16-9-7-5-4-6-8-12-20-13-10-14-21(18-20)27-3/h10,13-14,18,22H,4-9,11-12,15-17,19H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.35E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bras£lia Curated by ChEMBL					Assay Description Inhibition of horse butyrylcholine esterase preincubated for 10 mins followed by the addition of butyrylcholine iodide as substrate measured after 5 ...				Eur J Med Chem 108: 687-700 (2016) Article DOI: 10.1016/j.ejmech.2015.12.024 BindingDB Entry DOI: 10.7270/Q20R9R7V
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50597594 (CHEMBL5183866) Show SMILES OCCCCCCCCc1ccc(CN2CCCCC2)c(O)c1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1039/d1md00046b BindingDB Entry DOI: 10.7270/Q2WM1JG5
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50597593 (CHEMBL5192958) Show SMILES OCCCCCCCCc1ccc(CN2CCCC2)c(O)c1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.76E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1039/d1md00046b BindingDB Entry DOI: 10.7270/Q2WM1JG5
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50597595 (CHEMBL5190179) Show SMILES OCCCCCCCCc1ccc(CN2CCCCCC2)c(O)c1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.85E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1039/d1md00046b BindingDB Entry DOI: 10.7270/Q2WM1JG5
					More data for this Ligand-Target Pair