Compile Data Set for Download or QSAR

Found 32 hits Enz. Inhib. hit(s) with all data for entry = 50040029   

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 (Rattus norvegicus (rat))	BDBM50004000 ((3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydro...) Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1 |r| Show InChI InChI=1S/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of AChE in Wistar rat brain homogenate using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM10622 ((-)-Phenserine | (3aS)-1,3a,8-trimethyl-1H,2H,3H,3...) Show SMILES CN1CC[C@]2(C)C1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 |r| Show InChI InChI=1S/C20H23N3O2/c1-20-11-12-22(2)18(20)23(3)17-10-9-15(13-16(17)20)25-19(24)21-14-7-5-4-6-8-14/h4-10,13,18H,11-12H2,1-3H3,(H,21,24)/t18?,20-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	28.3	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of AChE in Wistar rat brain homogenate using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50004000 ((3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydro...) Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1 |r| Show InChI InChI=1S/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15+/m1/s1	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	58.4	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of BuChE in Wistar rat plasma using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50388138 (CHEMBL2059199) Show SMILES CC[C@]12CCN(C)[C@@H]1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 |r| Show InChI InChI=1S/C21H25N3O2/c1-4-21-12-13-23(2)19(21)24(3)18-11-10-16(14-17(18)21)26-20(25)22-15-8-6-5-7-9-15/h5-11,14,19H,4,12-13H2,1-3H3,(H,22,25)/t19-,21-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	373	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of AChE in Wistar rat brain homogenate using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50388133 (CHEMBL2058983) Show SMILES CCC12CCN(C)C1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 Show InChI InChI=1S/C21H25N3O2/c1-4-21-12-13-23(2)19(21)24(3)18-11-10-16(14-17(18)21)26-20(25)22-15-8-6-5-7-9-15/h5-11,14,19H,4,12-13H2,1-3H3,(H,22,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	397	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of AChE in Wistar rat brain homogenate using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50388137 (CHEMBL2058987) Show SMILES CN1CC[C@]2(C=C)[C@H]1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 |r| Show InChI InChI=1S/C21H23N3O2/c1-4-21-12-13-23(2)19(21)24(3)18-11-10-16(14-17(18)21)26-20(25)22-15-8-6-5-7-9-15/h4-11,14,19H,1,12-13H2,2-3H3,(H,22,25)/t19-,21+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	644	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of AChE in Wistar rat brain homogenate using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50388131 (CHEMBL2058982) Show SMILES CN1CCC2(C=C)C1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 Show InChI InChI=1S/C21H23N3O2/c1-4-21-12-13-23(2)19(21)24(3)18-11-10-16(14-17(18)21)26-20(25)22-15-8-6-5-7-9-15/h4-11,14,19H,1,12-13H2,2-3H3,(H,22,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	749	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of AChE in Wistar rat brain homogenate using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50388135 (CHEMBL2058986) Show SMILES CN1CC[C@@]2(CC=C)[C@H]1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 |r| Show InChI InChI=1S/C22H25N3O2/c1-4-12-22-13-14-24(2)20(22)25(3)19-11-10-17(15-18(19)22)27-21(26)23-16-8-6-5-7-9-16/h4-11,15,20H,1,12-14H2,2-3H3,(H,23,26)/t20-,22-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of AChE in Wistar rat brain homogenate using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50388132 (CHEMBL2058980) Show SMILES CN1CCC2(CC=C)C1N(C)c1ccc(OC(=O)Nc3ccccc3F)cc21 Show InChI InChI=1S/C22H24FN3O2/c1-4-11-22-12-13-25(2)20(22)26(3)19-10-9-15(14-16(19)22)28-21(27)24-18-8-6-5-7-17(18)23/h4-10,14,20H,1,11-13H2,2-3H3,(H,24,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.55E+3	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of AChE in Wistar rat brain homogenate using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50388130 (CHEMBL2058981) Show SMILES CCCC12CCN(C)C1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 Show InChI InChI=1S/C22H27N3O2/c1-4-12-22-13-14-24(2)20(22)25(3)19-11-10-17(15-18(19)22)27-21(26)23-16-8-6-5-7-9-16/h5-11,15,20H,4,12-14H2,1-3H3,(H,23,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.66E+3	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of AChE in Wistar rat brain homogenate using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50388135 (CHEMBL2058986) Show SMILES CN1CC[C@@]2(CC=C)[C@H]1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 |r| Show InChI InChI=1S/C22H25N3O2/c1-4-12-22-13-14-24(2)20(22)25(3)19-11-10-17(15-18(19)22)27-21(26)23-16-8-6-5-7-9-16/h4-11,15,20H,1,12-14H2,2-3H3,(H,23,26)/t20-,22-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.77E+3	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of AChE in Wistar rat brain homogenate using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50388129 (CHEMBL2058979) Show SMILES CN1CCC2(CC=C)C1N(C)c1ccc(OC(=O)Nc3ccc(F)cc3)cc21 Show InChI InChI=1S/C22H24FN3O2/c1-4-11-22-12-13-25(2)20(22)26(3)19-10-9-17(14-18(19)22)28-21(27)24-16-7-5-15(23)6-8-16/h4-10,14,20H,1,11-13H2,2-3H3,(H,24,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.36E+3	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of AChE in Wistar rat brain homogenate using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50388136 (CHEMBL2058985) Show SMILES CN1C2N(C)c3ccc(OC(=O)Nc4ccccc4)cc3C2(CC=C)CC1=O Show InChI InChI=1S/C22H23N3O3/c1-4-12-22-14-19(26)25(3)20(22)24(2)18-11-10-16(13-17(18)22)28-21(27)23-15-8-6-5-7-9-15/h4-11,13,20H,1,12,14H2,2-3H3,(H,23,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.73E+3	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of AChE in Wistar rat brain homogenate using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50388139 (CHEMBL2059200) Show SMILES CCC(C)(C)[C@@]12CCN(C)[C@@H]1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 |r| Show InChI InChI=1S/C24H31N3O2/c1-6-23(2,3)24-14-15-26(4)21(24)27(5)20-13-12-18(16-19(20)24)29-22(28)25-17-10-8-7-9-11-17/h7-13,16,21H,6,14-15H2,1-5H3,(H,25,28)/t21-,24-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of AChE in Wistar rat brain homogenate using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50388140 (CHEMBL2058977) Show SMILES CC(C)c1ccc(NC(=O)Oc2ccc3N(C)C4N(C)CCC4(CC=C)c3c2)cc1 Show InChI InChI=1S/C25H31N3O2/c1-6-13-25-14-15-27(4)23(25)28(5)22-12-11-20(16-21(22)25)30-24(29)26-19-9-7-18(8-10-19)17(2)3/h6-12,16-17,23H,1,13-15H2,2-5H3,(H,26,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD 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
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of AChE in Wistar rat brain homogenate using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50388128 (CHEMBL2058978) Show SMILES CN1CCC2(CC=C)C1N(C)c1ccc(OC(=O)Nc3ccc(Br)cc3)cc21 Show InChI InChI=1S/C22H24BrN3O2/c1-4-11-22-12-13-25(2)20(22)26(3)19-10-9-17(14-18(19)22)28-21(27)24-16-7-5-15(23)6-8-16/h4-10,14,20H,1,11-13H2,2-3H3,(H,24,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD 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
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of AChE in Wistar rat brain homogenate using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50388140 (CHEMBL2058977) Show SMILES CC(C)c1ccc(NC(=O)Oc2ccc3N(C)C4N(C)CCC4(CC=C)c3c2)cc1 Show InChI InChI=1S/C25H31N3O2/c1-6-13-25-14-15-27(4)23(25)28(5)22-12-11-20(16-21(22)25)30-24(29)26-19-9-7-18(8-10-19)17(2)3/h6-12,16-17,23H,1,13-15H2,2-5H3,(H,26,29)	Reactome pathway KEGG UniProtKB/TrEMBL 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
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of BuChE in Wistar rat plasma using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50388128 (CHEMBL2058978) Show SMILES CN1CCC2(CC=C)C1N(C)c1ccc(OC(=O)Nc3ccc(Br)cc3)cc21 Show InChI InChI=1S/C22H24BrN3O2/c1-4-11-22-12-13-25(2)20(22)26(3)19-10-9-17(14-18(19)22)28-21(27)24-16-7-5-15(23)6-8-16/h4-10,14,20H,1,11-13H2,2-3H3,(H,24,27)	Reactome pathway KEGG UniProtKB/TrEMBL 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
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of BuChE in Wistar rat plasma using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50388134 (CHEMBL2058984) Show SMILES CCC(C)(C)C12CCN(C)C1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 Show InChI InChI=1S/C24H31N3O2/c1-6-23(2,3)24-14-15-26(4)21(24)27(5)20-13-12-18(16-19(20)24)29-22(28)25-17-10-8-7-9-11-17/h7-13,16,21H,6,14-15H2,1-5H3,(H,25,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.84E+4	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of AChE in Wistar rat brain homogenate using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM10622 ((-)-Phenserine | (3aS)-1,3a,8-trimethyl-1H,2H,3H,3...) Show SMILES CN1CC[C@]2(C)C1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 |r| Show InChI InChI=1S/C20H23N3O2/c1-20-11-12-22(2)18(20)23(3)17-10-9-15(13-16(17)20)25-19(24)21-14-7-5-4-6-8-14/h4-10,13,18H,11-12H2,1-3H3,(H,21,24)/t18?,20-/m0/s1	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of BuChE in Wistar rat plasma using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50388131 (CHEMBL2058982) Show SMILES CN1CCC2(C=C)C1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 Show InChI InChI=1S/C21H23N3O2/c1-4-21-12-13-23(2)19(21)24(3)18-11-10-16(14-17(18)21)26-20(25)22-15-8-6-5-7-9-15/h4-11,14,19H,1,12-13H2,2-3H3,(H,22,25)	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of BuChE in Wistar rat plasma using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50388133 (CHEMBL2058983) Show SMILES CCC12CCN(C)C1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 Show InChI InChI=1S/C21H25N3O2/c1-4-21-12-13-23(2)19(21)24(3)18-11-10-16(14-17(18)21)26-20(25)22-15-8-6-5-7-9-15/h5-11,14,19H,4,12-13H2,1-3H3,(H,22,25)	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of BuChE in Wistar rat plasma using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50388138 (CHEMBL2059199) Show SMILES CC[C@]12CCN(C)[C@@H]1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 |r| Show InChI InChI=1S/C21H25N3O2/c1-4-21-12-13-23(2)19(21)24(3)18-11-10-16(14-17(18)21)26-20(25)22-15-8-6-5-7-9-15/h5-11,14,19H,4,12-13H2,1-3H3,(H,22,25)/t19-,21-/m1/s1	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.62E+4	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of BuChE in Wistar rat plasma using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50388137 (CHEMBL2058987) Show SMILES CN1CC[C@]2(C=C)[C@H]1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 |r| Show InChI InChI=1S/C21H23N3O2/c1-4-21-12-13-23(2)19(21)24(3)18-11-10-16(14-17(18)21)26-20(25)22-15-8-6-5-7-9-15/h4-11,14,19H,1,12-13H2,2-3H3,(H,22,25)/t19-,21+/m1/s1	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.19E+4	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of BuChE in Wistar rat plasma using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50388136 (CHEMBL2058985) Show SMILES CN1C2N(C)c3ccc(OC(=O)Nc4ccccc4)cc3C2(CC=C)CC1=O Show InChI InChI=1S/C22H23N3O3/c1-4-12-22-14-19(26)25(3)20(22)24(2)18-11-10-16(13-17(18)22)28-21(27)23-15-8-6-5-7-9-15/h4-11,13,20H,1,12,14H2,2-3H3,(H,23,27)	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.53E+4	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of BuChE in Wistar rat plasma using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50388132 (CHEMBL2058980) Show SMILES CN1CCC2(CC=C)C1N(C)c1ccc(OC(=O)Nc3ccccc3F)cc21 Show InChI InChI=1S/C22H24FN3O2/c1-4-11-22-12-13-25(2)20(22)26(3)19-10-9-15(14-16(19)22)28-21(27)24-18-8-6-5-7-17(18)23/h4-10,14,20H,1,11-13H2,2-3H3,(H,24,27)	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.73E+4	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of BuChE in Wistar rat plasma using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50388135 (CHEMBL2058986) Show SMILES CN1CC[C@@]2(CC=C)[C@H]1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 |r| Show InChI InChI=1S/C22H25N3O2/c1-4-12-22-13-14-24(2)20(22)25(3)19-11-10-17(15-18(19)22)27-21(26)23-16-8-6-5-7-9-16/h4-11,15,20H,1,12-14H2,2-3H3,(H,23,26)/t20-,22-/m1/s1	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of BuChE in Wistar rat plasma using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50388139 (CHEMBL2059200) Show SMILES CCC(C)(C)[C@@]12CCN(C)[C@@H]1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 |r| Show InChI InChI=1S/C24H31N3O2/c1-6-23(2,3)24-14-15-26(4)21(24)27(5)20-13-12-18(16-19(20)24)29-22(28)25-17-10-8-7-9-11-17/h7-13,16,21H,6,14-15H2,1-5H3,(H,25,28)/t21-,24-/m1/s1	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of BuChE in Wistar rat plasma using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50388135 (CHEMBL2058986) Show SMILES CN1CC[C@@]2(CC=C)[C@H]1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 |r| Show InChI InChI=1S/C22H25N3O2/c1-4-12-22-13-14-24(2)20(22)25(3)19-11-10-17(15-18(19)22)27-21(26)23-16-8-6-5-7-9-16/h4-11,15,20H,1,12-14H2,2-3H3,(H,23,26)/t20-,22-/m1/s1	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of BuChE in Wistar rat plasma using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50388134 (CHEMBL2058984) Show SMILES CCC(C)(C)C12CCN(C)C1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 Show InChI InChI=1S/C24H31N3O2/c1-6-23(2,3)24-14-15-26(4)21(24)27(5)20-13-12-18(16-19(20)24)29-22(28)25-17-10-8-7-9-11-17/h7-13,16,21H,6,14-15H2,1-5H3,(H,25,28)	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of BuChE in Wistar rat plasma using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50388130 (CHEMBL2058981) Show SMILES CCCC12CCN(C)C1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21 Show InChI InChI=1S/C22H27N3O2/c1-4-12-22-13-14-24(2)20(22)25(3)19-11-10-17(15-18(19)22)27-21(26)23-16-8-6-5-7-9-16/h5-11,15,20H,4,12-14H2,1-3H3,(H,23,26)	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of BuChE in Wistar rat plasma using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50388129 (CHEMBL2058979) Show SMILES CN1CCC2(CC=C)C1N(C)c1ccc(OC(=O)Nc3ccc(F)cc3)cc21 Show InChI InChI=1S/C22H24FN3O2/c1-4-11-22-12-13-25(2)20(22)26(3)19-10-9-17(14-18(19)22)28-21(27)24-16-7-5-15(23)6-8-16/h4-10,14,20H,1,11-13H2,2-3H3,(H,24,27)	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Meiji Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of BuChE in Wistar rat plasma using acetylthiocholine iodide as substrate after 0.5 hrs by Ellman's method				Bioorg Med Chem 20: 4901-14 (2012) Article DOI: 10.1016/j.bmc.2012.06.048 BindingDB Entry DOI: 10.7270/Q2W66MVP
					More data for this Ligand-Target Pair