Compile Data Set for Download or QSAR

Found 62 hits Enz. Inhib. hit(s) with all data for entry = 50036956   

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))	BDBM50102738 (CHEMBL1204162 | CHEMBL281799 | [2-(1-Benzyl-piperi...) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1cc2Cc3ccccc3-c2nn1 Show InChI InChI=1S/C25H28N4/c1-2-6-20(7-3-1)18-29-14-11-19(12-15-29)10-13-26-24-17-22-16-21-8-4-5-9-23(21)25(22)28-27-24/h1-9,17,19H,10-16,18H2,(H,26,27)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM8960 ((+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimet...) Show SMILES COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of acetylcholinesterase from human erythrocytes				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair				3D Structure (crystal)
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50102726 (CHEMBL1204299 | CHEMBL91240 | N-(2-(1-benzylpiperi...) Show SMILES Cc1cc(NCCC2CCN(Cc3ccccc3)CC2)nnc1-c1ccccc1 Show InChI InChI=1S/C25H30N4/c1-20-18-24(27-28-25(20)23-10-6-3-7-11-23)26-15-12-21-13-16-29(17-14-21)19-22-8-4-2-5-9-22/h2-11,18,21H,12-17,19H2,1H3,(H,26,27)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	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 MMDB 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	PDB PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of butyrylcholinesterase from human serum				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair				3D Structure (crystal)
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50369842 (CHEMBL1202865) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1cc2CCCc3ccccc3-c2nn1 Show InChI InChI=1S/C27H32N4/c1-2-7-22(8-3-1)20-31-17-14-21(15-18-31)13-16-28-26-19-24-11-6-10-23-9-4-5-12-25(23)27(24)30-29-26/h1-5,7-9,12,19,21H,6,10-11,13-18,20H2,(H,28,29)	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50369848 (CHEMBL1202884) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1cc2ccc3ccccc3c2nn1 Show InChI InChI=1S/C26H28N4/c1-2-6-21(7-3-1)19-30-16-13-20(14-17-30)12-15-27-25-18-23-11-10-22-8-4-5-9-24(22)26(23)29-28-25/h1-11,18,20H,12-17,19H2,(H,27,28)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50102729 (CHEMBL1204296 | CHEMBL90264 | N-(2-(1-benzylpiperi...) Show SMILES CCc1cc(NCCC2CCN(Cc3ccccc3)CC2)nnc1-c1ccccc1 Show InChI InChI=1S/C26H32N4/c1-2-23-19-25(28-29-26(23)24-11-7-4-8-12-24)27-16-13-21-14-17-30(18-15-21)20-22-9-5-3-6-10-22/h3-12,19,21H,2,13-18,20H2,1H3,(H,27,28)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50369837 (CHEMBL1202885) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1cc2CCc3ccccc3-c2nn1 Show InChI InChI=1S/C26H30N4/c1-2-6-21(7-3-1)19-30-16-13-20(14-17-30)12-15-27-25-18-23-11-10-22-8-4-5-9-24(22)26(23)29-28-25/h1-9,18,20H,10-17,19H2,(H,27,28)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	39	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50102726 (CHEMBL1204299 | CHEMBL91240 | N-(2-(1-benzylpiperi...) Show SMILES Cc1cc(NCCC2CCN(Cc3ccccc3)CC2)nnc1-c1ccccc1 Show InChI InChI=1S/C25H30N4/c1-20-18-24(27-28-25(20)23-10-6-3-7-11-23)26-15-12-21-13-16-29(17-14-21)19-22-8-4-2-5-9-22/h2-11,18,21H,12-17,19H2,1H3,(H,26,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	39	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of acetylcholinesterase from human erythrocytes				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					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	PubMed	n/a	n/a	39	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM8960 ((+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimet...) Show SMILES COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	48	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50369849 (CHEMBL1202882) Show SMILES CC(=O)c1cccc(c1)-c1ccc(NCCC2CCN(Cc3ccccc3)CC2)nn1 Show InChI InChI=1S/C26H30N4O/c1-20(31)23-8-5-9-24(18-23)25-10-11-26(29-28-25)27-15-12-21-13-16-30(17-14-21)19-22-6-3-2-4-7-22/h2-11,18,21H,12-17,19H2,1H3,(H,27,29)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	54	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50369868 (CHEMBL1202859) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1ccc(nn1)-c1ccc2ccccc2c1 Show InChI InChI=1S/C28H30N4/c1-2-6-23(7-3-1)21-32-18-15-22(16-19-32)14-17-29-28-13-12-27(30-31-28)26-11-10-24-8-4-5-9-25(24)20-26/h1-13,20,22H,14-19,21H2,(H,29,31)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	56	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50369858 (CHEMBL1202860) Show SMILES FC(F)(F)c1cc(cc(c1)C(F)(F)F)-c1ccc(NCCC2CCN(Cc3ccccc3)CC2)nn1 Show InChI InChI=1S/C26H26F6N4/c27-25(28,29)21-14-20(15-22(16-21)26(30,31)32)23-6-7-24(35-34-23)33-11-8-18-9-12-36(13-10-18)17-19-4-2-1-3-5-19/h1-7,14-16,18H,8-13,17H2,(H,33,35)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	56	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50369853 (CHEMBL1202877) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1ccc(nn1)-c1cccnc1 Show InChI InChI=1S/C23H27N5/c1-2-5-20(6-3-1)18-28-15-11-19(12-16-28)10-14-25-23-9-8-22(26-27-23)21-7-4-13-24-17-21/h1-9,13,17,19H,10-12,14-16,18H2,(H,25,27)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	57	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50369867 (CHEMBL1202883) Show SMILES CC(=O)Nc1cccc(c1)-c1ccc(NCCC2CCN(Cc3ccccc3)CC2)nn1 Show InChI InChI=1S/C26H31N5O/c1-20(32)28-24-9-5-8-23(18-24)25-10-11-26(30-29-25)27-15-12-21-13-16-31(17-14-21)19-22-6-3-2-4-7-22/h2-11,18,21H,12-17,19H2,1H3,(H,27,30)(H,28,32)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	58	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50102743 (CHEMBL1204295 | CHEMBL91432 | N-(2-(1-benzylpiperi...) Show SMILES CCCc1cc(NCCC2CCN(Cc3ccccc3)CC2)nnc1-c1ccccc1 Show InChI InChI=1S/C27H34N4/c1-2-9-25-20-26(29-30-27(25)24-12-7-4-8-13-24)28-17-14-22-15-18-31(19-16-22)21-23-10-5-3-6-11-23/h3-8,10-13,20,22H,2,9,14-19,21H2,1H3,(H,28,29)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	61	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50102729 (CHEMBL1204296 | CHEMBL90264 | N-(2-(1-benzylpiperi...) Show SMILES CCc1cc(NCCC2CCN(Cc3ccccc3)CC2)nnc1-c1ccccc1 Show InChI InChI=1S/C26H32N4/c1-2-23-19-25(28-29-26(23)24-11-7-4-8-12-24)27-16-13-21-14-17-30(18-15-21)20-22-9-5-3-6-10-22/h3-12,19,21H,2,13-18,20H2,1H3,(H,27,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	66	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of acetylcholinesterase from human erythrocytes				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50102735 (CHEMBL91538 | [2-(1-Benzyl-piperidin-4-yl)-ethyl]-...) Show SMILES Clc1ccc(NCCC2CCN(Cc3ccccc3)CC2)nn1 Show InChI InChI=1S/C18H23ClN4/c19-17-6-7-18(22-21-17)20-11-8-15-9-12-23(13-10-15)14-16-4-2-1-3-5-16/h1-7,15H,8-14H2,(H,20,22)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	73	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50369839 (CHEMBL1202881) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1ccc(nn1)-c1ccc2OCOc2c1 Show InChI InChI=1S/C25H28N4O2/c1-2-4-20(5-3-1)17-29-14-11-19(12-15-29)10-13-26-25-9-7-22(27-28-25)21-6-8-23-24(16-21)31-18-30-23/h1-9,16,19H,10-15,17-18H2,(H,26,28)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	73	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50102738 (CHEMBL1204162 | CHEMBL281799 | [2-(1-Benzyl-piperi...) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1cc2Cc3ccccc3-c2nn1 Show InChI InChI=1S/C25H28N4/c1-2-6-20(7-3-1)18-29-14-11-19(12-15-29)10-13-26-24-17-22-16-21-8-4-5-9-23(21)25(22)28-27-24/h1-9,17,19H,10-16,18H2,(H,26,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	74	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of acetylcholinesterase from human erythrocytes				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50102755 (CHEMBL313415 | [2-(1-Benzyl-piperidin-4-yl)-ethyl]...) Show SMILES Clc1ccccc1-c1ccc(NCCC2CCN(Cc3ccccc3)CC2)nn1 Show InChI InChI=1S/C24H27ClN4/c25-22-9-5-4-8-21(22)23-10-11-24(28-27-23)26-15-12-19-13-16-29(17-14-19)18-20-6-2-1-3-7-20/h1-11,19H,12-18H2,(H,26,28)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50369866 (CHEMBL1202864) Show SMILES CCc1ccccc1-c1ccc(NCCC2CCN(Cc3ccccc3)CC2)nn1 Show InChI InChI=1S/C26H32N4/c1-2-23-10-6-7-11-24(23)25-12-13-26(29-28-25)27-17-14-21-15-18-30(19-16-21)20-22-8-4-3-5-9-22/h3-13,21H,2,14-20H2,1H3,(H,27,29)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	87	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50369844 (CHEMBL1202868) Show SMILES Cc1ccccc1-c1ccc(NCCC2CCN(Cc3ccccc3)CC2)nn1 Show InChI InChI=1S/C25H30N4/c1-20-7-5-6-10-23(20)24-11-12-25(28-27-24)26-16-13-21-14-17-29(18-15-21)19-22-8-3-2-4-9-22/h2-12,21H,13-19H2,1H3,(H,26,28)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	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 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	PDB PubMed	n/a	n/a	95	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of acetylcholinesterase from human erythrocytes				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair				3D Structure (crystal)
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50369843 (CHEMBL1202878) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1ccc(nn1)-c1cccs1 Show InChI InChI=1S/C22H26N4S/c1-2-5-19(6-3-1)17-26-14-11-18(12-15-26)10-13-23-22-9-8-20(24-25-22)21-7-4-16-27-21/h1-9,16,18H,10-15,17H2,(H,23,25)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	97	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50369851 (CHEMBL1202880) Show SMILES N#Cc1ccc(cc1)-c1ccc(NCCC2CCN(Cc3ccccc3)CC2)nn1 Show InChI InChI=1S/C25H27N5/c26-18-21-6-8-23(9-7-21)24-10-11-25(29-28-24)27-15-12-20-13-16-30(17-14-20)19-22-4-2-1-3-5-22/h1-11,20H,12-17,19H2,(H,27,29)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50369854 (CHEMBL1202866) Show SMILES COc1ccccc1-c1ccc(NCCC2CCN(Cc3ccccc3)CC2)nn1 Show InChI InChI=1S/C25H30N4O/c1-30-24-10-6-5-9-22(24)23-11-12-25(28-27-23)26-16-13-20-14-17-29(18-15-20)19-21-7-3-2-4-8-21/h2-12,20H,13-19H2,1H3,(H,26,28)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50369842 (CHEMBL1202865) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1cc2CCCc3ccccc3-c2nn1 Show InChI InChI=1S/C27H32N4/c1-2-7-22(8-3-1)20-31-17-14-21(15-18-31)13-16-28-26-19-24-11-6-10-23-9-4-5-12-25(23)27(24)30-29-26/h1-5,7-9,12,19,21H,6,10-11,13-18,20H2,(H,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of acetylcholinesterase from human erythrocytes				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50074277 (CHEMBL25412 | [2-(1-Benzyl-piperidin-4-yl)-ethyl]-...) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1ccc(nn1)-c1ccccc1 Show InChI InChI=1S/C24H28N4/c1-3-7-21(8-4-1)19-28-17-14-20(15-18-28)13-16-25-24-12-11-23(26-27-24)22-9-5-2-6-10-22/h1-12,20H,13-19H2,(H,25,27)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50074277 (CHEMBL25412 | [2-(1-Benzyl-piperidin-4-yl)-ethyl]-...) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1ccc(nn1)-c1ccccc1 Show InChI InChI=1S/C24H28N4/c1-3-7-21(8-4-1)19-28-17-14-20(15-18-28)13-16-25-24-12-11-23(26-27-24)22-9-5-2-6-10-22/h1-12,20H,13-19H2,(H,25,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of acetylcholinesterase from human erythrocytes				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50369837 (CHEMBL1202885) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1cc2CCc3ccccc3-c2nn1 Show InChI InChI=1S/C26H30N4/c1-2-6-21(7-3-1)19-30-16-13-20(14-17-30)12-15-27-25-18-23-11-10-22-8-4-5-9-24(22)26(23)29-28-25/h1-9,18,20H,10-17,19H2,(H,27,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of acetylcholinesterase from human erythrocytes				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50369848 (CHEMBL1202884) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1cc2ccc3ccccc3c2nn1 Show InChI InChI=1S/C26H28N4/c1-2-6-21(7-3-1)19-30-16-13-20(14-17-30)12-15-27-25-18-23-11-10-22-8-4-5-9-24(22)26(23)29-28-25/h1-11,18,20H,12-17,19H2,(H,27,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of acetylcholinesterase from human erythrocytes				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50369865 (CHEMBL1202879) Show SMILES CN(C)c1ccc(cc1)-c1ccc(NCCC2CCN(Cc3ccccc3)CC2)nn1 Show InChI InChI=1S/C26H33N5/c1-30(2)24-10-8-23(9-11-24)25-12-13-26(29-28-25)27-17-14-21-15-18-31(19-16-21)20-22-6-4-3-5-7-22/h3-13,21H,14-20H2,1-2H3,(H,27,29)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50369855 (CHEMBL1202869) Show SMILES COc1ccc(NCCC2CCN(Cc3ccccc3)CC2)nn1 Show InChI InChI=1S/C19H26N4O/c1-24-19-8-7-18(21-22-19)20-12-9-16-10-13-23(14-11-16)15-17-5-3-2-4-6-17/h2-8,16H,9-15H2,1H3,(H,20,21)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50102738 (CHEMBL1204162 | CHEMBL281799 | [2-(1-Benzyl-piperi...) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1cc2Cc3ccccc3-c2nn1 Show InChI InChI=1S/C25H28N4/c1-2-6-20(7-3-1)18-29-14-11-19(12-15-29)10-13-26-24-17-22-16-21-8-4-5-9-23(21)25(22)28-27-24/h1-9,17,19H,10-16,18H2,(H,26,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of butyrylcholinesterase from human serum				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50369850 (CHEMBL1202870) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1cccnn1 Show InChI InChI=1S/C18H24N4/c1-2-5-17(6-3-1)15-22-13-9-16(10-14-22)8-12-19-18-7-4-11-20-21-18/h1-7,11,16H,8-10,12-15H2,(H,19,21)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	240	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50369848 (CHEMBL1202884) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1cc2ccc3ccccc3c2nn1 Show InChI InChI=1S/C26H28N4/c1-2-6-21(7-3-1)19-30-16-13-20(14-17-30)12-15-27-25-18-23-11-10-22-8-4-5-9-24(22)26(23)29-28-25/h1-11,18,20H,12-17,19H2,(H,27,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of butyrylcholinesterase from human serum				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50369837 (CHEMBL1202885) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1cc2CCc3ccccc3-c2nn1 Show InChI InChI=1S/C26H30N4/c1-2-6-21(7-3-1)19-30-16-13-20(14-17-30)12-15-27-25-18-23-11-10-22-8-4-5-9-24(22)26(23)29-28-25/h1-9,18,20H,10-17,19H2,(H,27,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of butyrylcholinesterase from human serum				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50102754 (CHEMBL1204300 | CHEMBL94054 | N-(2-(1-benzylpiperi...) Show SMILES Cc1cc(nnc1NCCC1CCN(Cc2ccccc2)CC1)-c1ccccc1 Show InChI InChI=1S/C25H30N4/c1-20-18-24(23-10-6-3-7-11-23)27-28-25(20)26-15-12-21-13-16-29(17-14-21)19-22-8-4-2-5-9-22/h2-11,18,21H,12-17,19H2,1H3,(H,26,28)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	320	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50369860 (CHEMBL1202876) Show SMILES Fc1ccc(cc1)-c1ccc(NCCC2CCN(Cc3ccccc3)CC2)nn1 Show InChI InChI=1S/C24H27FN4/c25-22-8-6-21(7-9-22)23-10-11-24(28-27-23)26-15-12-19-13-16-29(17-14-19)18-20-4-2-1-3-5-20/h1-11,19H,12-18H2,(H,26,28)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50102757 (CHEMBL1204298 | CHEMBL90241 | N-(2-(1-benzylpiperi...) Show SMILES CC(C)c1cc(nnc1NCCC1CCN(Cc2ccccc2)CC1)-c1ccccc1 Show InChI InChI=1S/C27H34N4/c1-21(2)25-19-26(24-11-7-4-8-12-24)29-30-27(25)28-16-13-22-14-17-31(18-15-22)20-23-9-5-3-6-10-23/h3-12,19,21-22H,13-18,20H2,1-2H3,(H,28,30)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	430	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50102737 (CHEMBL1204297 | CHEMBL91774 | N-(2-(1-benzylpiperi...) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1nnc(-c2ccccc2)c2ccccc12 Show InChI InChI=1S/C28H30N4/c1-3-9-23(10-4-1)21-32-19-16-22(17-20-32)15-18-29-28-26-14-8-7-13-25(26)27(30-31-28)24-11-5-2-6-12-24/h1-14,22H,15-21H2,(H,29,31)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	440	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of electric eel acetylcholinesterase				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50369861 (CHEMBL1202874) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Sc1ccc(nn1)-c1ccccc1 Show InChI InChI=1S/C24H27N3S/c1-3-7-21(8-4-1)19-27-16-13-20(14-17-27)15-18-28-24-12-11-23(25-26-24)22-9-5-2-6-10-22/h1-12,20H,13-19H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	470	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of acetylcholinesterase from human erythrocytes				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50369861 (CHEMBL1202874) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Sc1ccc(nn1)-c1ccccc1 Show InChI InChI=1S/C24H27N3S/c1-3-7-21(8-4-1)19-27-16-13-20(14-17-27)15-18-28-24-12-11-23(25-26-24)22-9-5-2-6-10-22/h1-12,20H,13-19H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	480	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of butyrylcholinesterase from human serum				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50369842 (CHEMBL1202865) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1cc2CCCc3ccccc3-c2nn1 Show InChI InChI=1S/C27H32N4/c1-2-7-22(8-3-1)20-31-17-14-21(15-18-31)13-16-28-26-19-24-11-6-10-23-9-4-5-12-25(23)27(24)30-29-26/h1-5,7-9,12,19,21H,6,10-11,13-18,20H2,(H,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	n/a	n/a	510	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of butyrylcholinesterase from human serum				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50074277 (CHEMBL25412 | [2-(1-Benzyl-piperidin-4-yl)-ethyl]-...) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Nc1ccc(nn1)-c1ccccc1 Show InChI InChI=1S/C24H28N4/c1-3-7-21(8-4-1)19-28-17-14-20(15-18-28)13-16-25-24-12-11-23(26-27-24)22-9-5-2-6-10-22/h1-12,20H,13-19H2,(H,25,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of butyrylcholinesterase from human serum				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50369840 (CHEMBL1202875) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)Oc1ccc(nn1)-c1ccccc1 Show InChI InChI=1S/C24H27N3O/c1-3-7-21(8-4-1)19-27-16-13-20(14-17-27)15-18-28-24-12-11-23(25-26-24)22-9-5-2-6-10-22/h1-12,20H,13-19H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	710	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description In vitro inhibition of acetylcholinesterase from human erythrocytes				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50102729 (CHEMBL1204296 | CHEMBL90264 | N-(2-(1-benzylpiperi...) Show SMILES CCc1cc(NCCC2CCN(Cc3ccccc3)CC2)nnc1-c1ccccc1 Show InChI InChI=1S/C26H32N4/c1-2-23-19-25(28-29-26(23)24-11-7-4-8-12-24)27-16-13-21-14-17-30(18-15-21)20-22-9-5-3-6-10-22/h3-12,19,21H,2,13-18,20H2,1H3,(H,27,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	920	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of butyrylcholinesterase from human serum				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50102726 (CHEMBL1204299 | CHEMBL91240 | N-(2-(1-benzylpiperi...) Show SMILES Cc1cc(NCCC2CCN(Cc3ccccc3)CC2)nnc1-c1ccccc1 Show InChI InChI=1S/C25H30N4/c1-20-18-24(27-28-25(20)23-10-6-3-7-11-23)26-15-12-21-13-16-29(17-14-21)19-22-8-4-2-5-9-22/h2-11,18,21H,12-17,19H2,1H3,(H,26,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	940	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Curated by ChEMBL					Assay Description Inhibition of butyrylcholinesterase from human serum				J Med Chem 44: 2707-18 (2001) BindingDB Entry DOI: 10.7270/Q2222VG9
					More data for this Ligand-Target Pair

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