Compile Data Set for Download or QSAR

Found 9 hits Enz. Inhib. hit(s) with Target = 'Acetylcholine receptor protein epsilon chain'   

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
Acetylcholine receptor protein epsilon chain (Homo sapiens)	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)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	44	n/a	n/a	n/a	n/a	n/a	n/a
University of Würzburg Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase				J Med Chem 48: 7496-9 (2005) Article DOI: 10.1021/jm058041z BindingDB Entry DOI: 10.7270/Q20864WZ
					More data for this Ligand-Target Pair
Acetylcholine receptor protein epsilon chain (Homo sapiens)	BDBM50177174 (9-amino-5,6,7,8-tetrahydroacridin-4yl)methano | CH...) Show SMILES Nc1c2CCCCc2nc2c(CO)cccc12 Show InChI InChI=1S/C14H16N2O/c15-13-10-5-1-2-7-12(10)16-14-9(8-17)4-3-6-11(13)14/h3-4,6,17H,1-2,5,7-8H2,(H2,15,16)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	125	n/a	n/a	n/a	n/a	n/a	n/a
University of Würzburg Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase				J Med Chem 48: 7496-9 (2005) Article DOI: 10.1021/jm058041z BindingDB Entry DOI: 10.7270/Q20864WZ
					More data for this Ligand-Target Pair
Acetylcholine receptor protein epsilon chain (Rattus norvegicus)	BDBM50448370 (CHEMBL3120178) Show SMILES C[N+](C)(CCCCCCC[N+](C)(C)CC#CCOC1=NOCC1)CCCN1C(=O)c2cccc3cccc(C1=O)c23 Show InChI InChI=1S/C33H46N4O4/c1-36(2,23-10-11-25-40-30-19-26-41-34-30)21-8-6-5-7-9-22-37(3,4)24-14-20-35-32(38)28-17-12-15-27-16-13-18-29(31(27)28)33(35)39/h12-13,15-18H,5-9,14,19-26H2,1-4H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.94E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Milano Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase in rat brain homogenate after 15 mins by Ellman assay				Eur J Med Chem 75: 222-32 (2014) Article DOI: 10.1016/j.ejmech.2014.01.032 BindingDB Entry DOI: 10.7270/Q2K075RG
					More data for this Ligand-Target Pair
Acetylcholine receptor protein epsilon chain (Rattus norvegicus)	BDBM50448375 (CHEMBL3121479) Show SMILES C[N+](C)(CCCCCCCC[N+](C)(C)CC#CCOC1=NOCC1)CCCN1C(=O)c2cccc3cccc(C1=O)c23 Show InChI InChI=1S/C34H48N4O4/c1-37(2,24-11-12-26-41-31-20-27-42-35-31)22-9-7-5-6-8-10-23-38(3,4)25-15-21-36-33(39)29-18-13-16-28-17-14-19-30(32(28)29)34(36)40/h13-14,16-19H,5-10,15,20-27H2,1-4H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Milano Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase in rat brain homogenate after 15 mins by Ellman assay				Eur J Med Chem 75: 222-32 (2014) Article DOI: 10.1016/j.ejmech.2014.01.032 BindingDB Entry DOI: 10.7270/Q2K075RG
					More data for this Ligand-Target Pair
Acetylcholine receptor protein epsilon chain (Rattus norvegicus)	BDBM50448374 (CHEMBL3121478) Show SMILES C[N+](C)(CCCCCC[N+](C)(C)CC#CCOC1=NOCC1)CCCN1C(=O)c2cccc3cccc(C1=O)c23 Show InChI InChI=1S/C32H44N4O4/c1-35(2,22-9-10-24-39-29-18-25-40-33-29)20-7-5-6-8-21-36(3,4)23-13-19-34-31(37)27-16-11-14-26-15-12-17-28(30(26)27)32(34)38/h11-12,14-17H,5-8,13,18-25H2,1-4H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.02E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Milano Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase in rat brain homogenate after 15 mins by Ellman assay				Eur J Med Chem 75: 222-32 (2014) Article DOI: 10.1016/j.ejmech.2014.01.032 BindingDB Entry DOI: 10.7270/Q2K075RG
					More data for this Ligand-Target Pair
Acetylcholine receptor protein epsilon chain (Rattus norvegicus)	BDBM50448369 (CHEMBL3121476) Show SMILES C[N+](C)(CCCCCCCC[N+](C)(C)CC#CCOC1=NOCC1)CCCN1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C30H46N4O4/c1-33(2,22-13-14-24-37-28-18-25-38-31-28)20-11-7-5-6-8-12-21-34(3,4)23-15-19-32-29(35)26-16-9-10-17-27(26)30(32)36/h9-10,16-17H,5-8,11-12,15,18-25H2,1-4H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.95E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Milano Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase in rat brain homogenate after 15 mins by Ellman assay				Eur J Med Chem 75: 222-32 (2014) Article DOI: 10.1016/j.ejmech.2014.01.032 BindingDB Entry DOI: 10.7270/Q2K075RG
					More data for this Ligand-Target Pair
Acetylcholine receptor protein epsilon chain (Rattus norvegicus)	BDBM50448371 (CHEMBL3121480) Show SMILES C[N+](C)(CCCCCC[N+]1(C)CCC(CC1)N1C(=O)c2cccc3cccc(C1=O)c23)CC#CCOC1=NOCC1 Show InChI InChI=1S/C33H44N4O4/c1-36(2,20-8-9-24-40-30-18-25-41-34-30)19-6-4-5-7-21-37(3)22-16-27(17-23-37)35-32(38)28-14-10-12-26-13-11-15-29(31(26)28)33(35)39/h10-15,27H,4-7,16-25H2,1-3H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.29E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Milano Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase in rat brain homogenate after 15 mins by Ellman assay				Eur J Med Chem 75: 222-32 (2014) Article DOI: 10.1016/j.ejmech.2014.01.032 BindingDB Entry DOI: 10.7270/Q2K075RG
					More data for this Ligand-Target Pair
Acetylcholine receptor protein epsilon chain (Rattus norvegicus)	BDBM50448372 (CHEMBL3121475) Show SMILES C[N+](C)(CCCCCCC[N+](C)(C)CC#CCOC1=NOCC1)CCCN1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C29H44N4O4/c1-32(2,21-12-13-23-36-27-17-24-37-30-27)19-10-6-5-7-11-20-33(3,4)22-14-18-31-28(34)25-15-8-9-16-26(25)29(31)35/h8-9,15-16H,5-7,10-11,14,17-24H2,1-4H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.16E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Milano Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase in rat brain homogenate after 15 mins by Ellman assay				Eur J Med Chem 75: 222-32 (2014) Article DOI: 10.1016/j.ejmech.2014.01.032 BindingDB Entry DOI: 10.7270/Q2K075RG
					More data for this Ligand-Target Pair
Acetylcholine receptor protein epsilon chain (Rattus norvegicus)	BDBM50448376 (NAPHMETHONIUM | Naphmethonium) Show SMILES CC(C)(CN1C(=O)c2cccc3cccc(C1=O)c23)C[N+](C)(C)CCCCCC[N+](C)(C)CCCN1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C38H50N4O4/c1-38(2,26-40-36(45)31-20-13-16-28-17-14-21-32(33(28)31)37(40)46)27-42(5,6)24-12-8-7-11-23-41(3,4)25-15-22-39-34(43)29-18-9-10-19-30(29)35(39)44/h9-10,13-14,16-21H,7-8,11-12,15,22-27H2,1-6H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.17E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Milano Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase in rat brain homogenate after 15 mins by Ellman assay				Eur J Med Chem 75: 222-32 (2014) Article DOI: 10.1016/j.ejmech.2014.01.032 BindingDB Entry DOI: 10.7270/Q2K075RG
					More data for this Ligand-Target Pair