Compile Data Set for Download or QSAR

Found 52 hits Enz. Inhib. hit(s) with all data for entry = 50030935   

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))	BDBM50304245 (6,7-Dimethoxy-3-[4-(pyrrolidin-1-ylmethyl)-phenyl]...) Show SMILES COc1cc2occ(-c3ccc(cc3)N3CCCC3)c(=O)c2cc1OC Show InChI InChI=1S/C21H21NO4/c1-24-19-11-16-18(12-20(19)25-2)26-13-17(21(16)23)14-5-7-15(8-6-14)22-9-3-4-10-22/h5-8,11-13H,3-4,9-10H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	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 KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair				3D Structure (crystal)
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304246 (6,7-Dimethoxy-2-[4-(piperidin-1-ylmethyl)-phenyl]-...) Show SMILES COc1cc2oc(cc(=O)c2cc1OC)-c1ccc(cc1)N1CCCCC1 Show InChI InChI=1S/C22H23NO4/c1-25-21-12-17-18(24)13-19(27-20(17)14-22(21)26-2)15-6-8-16(9-7-15)23-10-4-3-5-11-23/h6-9,12-14H,3-5,10-11H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304249 ((E)-1-(2-Hydroxy-4,5-dimethoxyphenyl)-3-[4-(pyrrol...) Show SMILES COc1cc(O)c(cc1OC)C(=O)\C=C\c1ccc(cc1)N1CCCC1 Show InChI InChI=1S/C21H23NO4/c1-25-20-13-17(19(24)14-21(20)26-2)18(23)10-7-15-5-8-16(9-6-15)22-11-3-4-12-22/h5-10,13-14,24H,3-4,11-12H2,1-2H3/b10-7+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	37	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304247 ((E)-1-(2-Hydroxy-4,5-dimethoxyphenyl)-3-[3-(pyrrol...) Show SMILES COc1cc(O)c(cc1OC)C(=O)\C=C\c1cccc(c1)N1CCCC1 Show InChI InChI=1S/C21H23NO4/c1-25-20-13-17(19(24)14-21(20)26-2)18(23)9-8-15-6-5-7-16(12-15)22-10-3-4-11-22/h5-9,12-14,24H,3-4,10-11H2,1-2H3/b9-8+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	47	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304248 (6,7-Dimethoxy-2-[4-(pyrrolidin-1-ylmethyl)-phenyl]...) Show SMILES COc1cc2oc(cc(=O)c2cc1OC)-c1ccc(cc1)N1CCCC1 Show InChI InChI=1S/C21H21NO4/c1-24-20-11-16-17(23)12-18(26-19(16)13-21(20)25-2)14-5-7-15(8-6-14)22-9-3-4-10-22/h5-8,11-13H,3-4,9-10H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304250 (6,7-Dimethoxy-3-[4-(piperidin-1-ylmethyl)-phenyl]-...) Show SMILES COc1cc2occ(-c3ccc(cc3)N3CCCCC3)c(=O)c2cc1OC Show InChI InChI=1S/C22H23NO4/c1-25-20-12-17-19(13-21(20)26-2)27-14-18(22(17)24)15-6-8-16(9-7-15)23-10-4-3-5-11-23/h6-9,12-14H,3-5,10-11H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	68	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304227 (6,7-Dimethoxy-3-[3-(pyrrolidin-1-ylmethyl)-phenyl]...) Show SMILES COc1cc2occ(-c3cccc(c3)N3CCCC3)c(=O)c2cc1OC Show InChI InChI=1S/C21H21NO4/c1-24-19-11-16-18(12-20(19)25-2)26-13-17(21(16)23)14-6-5-7-15(10-14)22-8-3-4-9-22/h5-7,10-13H,3-4,8-9H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304228 ((E)-3-{4-[(Diethylamino)-methyl]-phenyl}-1-(2-hydr...) Show SMILES CCN(CC)c1ccc(\C=C\C(=O)c2cc(OC)c(OC)cc2O)cc1 Show InChI InChI=1S/C21H25NO4/c1-5-22(6-2)16-10-7-15(8-11-16)9-12-18(23)17-13-20(25-3)21(26-4)14-19(17)24/h7-14,24H,5-6H2,1-4H3/b12-9+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	103	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304229 ((E)-1-(2-Hydroxy-4,5-dimethoxyphenyl)-3-[4-(piperi...) Show SMILES COc1cc(O)c(cc1OC)C(=O)\C=C\c1ccc(cc1)N1CCCCC1 Show InChI InChI=1S/C22H25NO4/c1-26-21-14-18(20(25)15-22(21)27-2)19(24)11-8-16-6-9-17(10-7-16)23-12-4-3-5-13-23/h6-11,14-15,25H,3-5,12-13H2,1-2H3/b11-8+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	122	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304230 ((E)-3-{4-[(Ethylmethylamino)-methyl]-phenyl}-1-(2-...) Show SMILES CCN(C)c1ccc(\C=C\C(=O)c2cc(OC)c(OC)cc2O)cc1 Show InChI InChI=1S/C20H23NO4/c1-5-21(2)15-9-6-14(7-10-15)8-11-17(22)16-12-19(24-3)20(25-4)13-18(16)23/h6-13,23H,5H2,1-4H3/b11-8+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	126	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304231 (6,7-Dimethoxy-3-{4-[(ethylmethylamino)-methyl]-phe...) Show SMILES CCN(C)c1ccc(cc1)-c1coc2cc(OC)c(OC)cc2c1=O Show InChI InChI=1S/C20H21NO4/c1-5-21(2)14-8-6-13(7-9-14)16-12-25-17-11-19(24-4)18(23-3)10-15(17)20(16)22/h6-12H,5H2,1-4H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	171	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304232 (6,7-Dimethoxy-2-[4-(piperidin-1-ylmethyl)-phenyl]-...) Show SMILES COc1cc2OC(CC(=O)c2cc1OC)c1ccc(cc1)N1CCCCC1 Show InChI InChI=1S/C22H25NO4/c1-25-21-12-17-18(24)13-19(27-20(17)14-22(21)26-2)15-6-8-16(9-7-15)23-10-4-3-5-11-23/h6-9,12,14,19H,3-5,10-11,13H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	248	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304233 (6,7-Dimethoxy-2-{4-[(ethylmethylamino)-methyl)-phe...) Show SMILES CCN(C)c1ccc(cc1)-c1cc(=O)c2cc(OC)c(OC)cc2o1 Show InChI InChI=1S/C20H21NO4/c1-5-21(2)14-8-6-13(7-9-14)17-11-16(22)15-10-19(23-3)20(24-4)12-18(15)25-17/h6-12H,5H2,1-4H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	336	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304234 (3-{3-[(Diethylamino)-methyl]-phenyl}-6,7-dimethoxy...) Show SMILES CCN(CC)c1cccc(c1)-c1coc2cc(OC)c(OC)cc2c1=O Show InChI InChI=1S/C21H23NO4/c1-5-22(6-2)15-9-7-8-14(10-15)17-13-26-18-12-20(25-4)19(24-3)11-16(18)21(17)23/h7-13H,5-6H2,1-4H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	560	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304235 (3-{4-[(Diethylamino)-methyl]-phenyl}-6,7-dimethoxy...) Show SMILES CCN(CC)c1ccc(cc1)-c1coc2cc(OC)c(OC)cc2c1=O Show InChI InChI=1S/C21H23NO4/c1-5-22(6-2)15-9-7-14(8-10-15)17-13-26-18-12-20(25-4)19(24-3)11-16(18)21(17)23/h7-13H,5-6H2,1-4H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	599	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304236 (2-[4-(Diethylamino-methyl)-phenyl]-6,7-dimethoxy-4...) Show SMILES CCN(CC)c1ccc(cc1)-c1cc(=O)c2cc(OC)c(OC)cc2o1 Show InChI InChI=1S/C21H23NO4/c1-5-22(6-2)15-9-7-14(8-10-15)18-12-17(23)16-11-20(24-3)21(25-4)13-19(16)26-18/h7-13H,5-6H2,1-4H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	639	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304237 (6,7-Dimethoxy-2-[3-(pyrrolidin-1-ylmethyl)-phenyl]...) Show SMILES COc1cc2oc(cc(=O)c2cc1OC)-c1cccc(c1)N1CCCC1 Show InChI InChI=1S/C21H21NO4/c1-24-20-11-16-17(23)12-18(26-19(16)13-21(20)25-2)14-6-5-7-15(10-14)22-8-3-4-9-22/h5-7,10-13H,3-4,8-9H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	704	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304238 (6,7-Dimethoxy-2-[4-(pyrrolidin-1-ylmethyl)-phenyl]...) Show SMILES COc1cc2OC(CC(=O)c2cc1OC)c1ccc(cc1)N1CCCC1 Show InChI InChI=1S/C21H23NO4/c1-24-20-11-16-17(23)12-18(26-19(16)13-21(20)25-2)14-5-7-15(8-6-14)22-9-3-4-10-22/h5-8,11,13,18H,3-4,9-10,12H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.24E+3	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304239 ((E)-3-{3-[(Diethylamino)-methyl]-phenyl}-1-(2-hydr...) Show SMILES CCN(CC)c1cccc(\C=C\C(=O)c2cc(OC)c(OC)cc2O)c1 Show InChI InChI=1S/C21H25NO4/c1-5-22(6-2)16-9-7-8-15(12-16)10-11-18(23)17-13-20(25-3)21(26-4)14-19(17)24/h7-14,24H,5-6H2,1-4H3/b11-10+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.61E+3	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM10620 ((S)-3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)...) Show SMILES [H][C@@](C)(N(C)C)c1cccc(OC(=O)N(C)CC)c1 Show InChI InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/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	1.66E+3	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM10620 ((S)-3-(1-(dimethylamino)ethyl)phenyl ethyl(methyl)...) Show SMILES [H][C@@](C)(N(C)C)c1cccc(OC(=O)N(C)CC)c1 Show InChI InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/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	2.25E+3	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304240 (6,7-Dimethoxy-2-{4-[(ethylmethylamino)-methyl]-phe...) Show SMILES CCN(C)c1ccc(cc1)C1CC(=O)c2cc(OC)c(OC)cc2O1 Show InChI InChI=1S/C20H23NO4/c1-5-21(2)14-8-6-13(7-9-14)17-11-16(22)15-10-19(23-3)20(24-4)12-18(15)25-17/h6-10,12,17H,5,11H2,1-4H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	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	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	4.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304241 (2-{4-[(Diethylamino)-methyl]-phenyl}-6,7-dimethoxy...) Show SMILES CCN(CC)c1ccc(cc1)C1CC(=O)c2cc(OC)c(OC)cc2O1 Show InChI InChI=1S/C21H25NO4/c1-5-22(6-2)15-9-7-14(8-10-15)18-12-17(23)16-11-20(24-3)21(25-4)13-19(16)26-18/h7-11,13,18H,5-6,12H2,1-4H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.97E+3	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304242 (6,7-Dimethoxy-2-[3-(pyrrolidin-1-ylmethyl)-phenyl]...) Show SMILES COc1cc2OC(CC(=O)c2cc1OC)c1cccc(c1)N1CCCC1 Show InChI InChI=1S/C21H23NO4/c1-24-20-11-16-17(23)12-18(26-19(16)13-21(20)25-2)14-6-5-7-15(10-14)22-8-3-4-9-22/h5-7,10-11,13,18H,3-4,8-9,12H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.36E+3	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50304243 (2-{3-[(Diethylamino)-methyl]-phenyl}-6,7-dimethoxy...) Show SMILES CCN(CC)c1cccc(c1)-c1cc(=O)c2cc(OC)c(OC)cc2o1 Show InChI InChI=1S/C21H23NO4/c1-5-22(6-2)15-9-7-8-14(10-15)18-12-17(23)16-11-20(24-3)21(25-4)13-19(16)26-18/h7-13H,5-6H2,1-4H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.99E+3	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of AChE in rat cortex after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304245 (6,7-Dimethoxy-3-[4-(pyrrolidin-1-ylmethyl)-phenyl]...) Show SMILES COc1cc2occ(-c3ccc(cc3)N3CCCC3)c(=O)c2cc1OC Show InChI InChI=1S/C21H21NO4/c1-24-19-11-16-18(12-20(19)25-2)26-13-17(21(16)23)14-5-7-15(8-6-14)22-9-3-4-10-22/h5-8,11-13H,3-4,9-10H2,1-2H3	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.83E+4	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304232 (6,7-Dimethoxy-2-[4-(piperidin-1-ylmethyl)-phenyl]-...) Show SMILES COc1cc2OC(CC(=O)c2cc1OC)c1ccc(cc1)N1CCCCC1 Show InChI InChI=1S/C22H25NO4/c1-25-21-12-17-18(24)13-19(27-20(17)14-22(21)26-2)15-6-8-16(9-7-15)23-10-4-3-5-11-23/h6-9,12,14,19H,3-5,10-11,13H2,1-2H3	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304231 (6,7-Dimethoxy-3-{4-[(ethylmethylamino)-methyl]-phe...) Show SMILES CCN(C)c1ccc(cc1)-c1coc2cc(OC)c(OC)cc2c1=O Show InChI InChI=1S/C20H21NO4/c1-5-21(2)14-8-6-13(7-9-14)16-12-25-17-11-19(24-4)18(23-3)10-15(17)20(16)22/h6-12H,5H2,1-4H3	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304236 (2-[4-(Diethylamino-methyl)-phenyl]-6,7-dimethoxy-4...) Show SMILES CCN(CC)c1ccc(cc1)-c1cc(=O)c2cc(OC)c(OC)cc2o1 Show InChI InChI=1S/C21H23NO4/c1-5-22(6-2)15-9-7-14(8-10-15)18-12-17(23)16-11-20(24-3)21(25-4)13-19(16)26-18/h7-13H,5-6H2,1-4H3	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.46E+4	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304238 (6,7-Dimethoxy-2-[4-(pyrrolidin-1-ylmethyl)-phenyl]...) Show SMILES COc1cc2OC(CC(=O)c2cc1OC)c1ccc(cc1)N1CCCC1 Show InChI InChI=1S/C21H23NO4/c1-24-20-11-16-17(23)12-18(26-19(16)13-21(20)25-2)14-5-7-15(8-6-14)22-9-3-4-10-22/h5-8,11,13,18H,3-4,9-10,12H2,1-2H3	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.82E+4	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304246 (6,7-Dimethoxy-2-[4-(piperidin-1-ylmethyl)-phenyl]-...) Show SMILES COc1cc2oc(cc(=O)c2cc1OC)-c1ccc(cc1)N1CCCCC1 Show InChI InChI=1S/C22H23NO4/c1-25-21-12-17-18(24)13-19(27-20(17)14-22(21)26-2)15-6-8-16(9-7-15)23-10-4-3-5-11-23/h6-9,12-14H,3-5,10-11H2,1-2H3	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.52E+4	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304247 ((E)-1-(2-Hydroxy-4,5-dimethoxyphenyl)-3-[3-(pyrrol...) Show SMILES COc1cc(O)c(cc1OC)C(=O)\C=C\c1cccc(c1)N1CCCC1 Show InChI InChI=1S/C21H23NO4/c1-25-20-13-17(19(24)14-21(20)26-2)18(23)9-8-15-6-5-7-16(12-15)22-10-3-4-11-22/h5-9,12-14,24H,3-4,10-11H2,1-2H3/b9-8+	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.73E+4	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304248 (6,7-Dimethoxy-2-[4-(pyrrolidin-1-ylmethyl)-phenyl]...) Show SMILES COc1cc2oc(cc(=O)c2cc1OC)-c1ccc(cc1)N1CCCC1 Show InChI InChI=1S/C21H21NO4/c1-24-20-11-16-17(23)12-18(26-19(16)13-21(20)25-2)14-5-7-15(8-6-14)22-9-3-4-10-22/h5-8,11-13H,3-4,9-10H2,1-2H3	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.97E+4	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304250 (6,7-Dimethoxy-3-[4-(piperidin-1-ylmethyl)-phenyl]-...) Show SMILES COc1cc2occ(-c3ccc(cc3)N3CCCCC3)c(=O)c2cc1OC Show InChI InChI=1S/C22H23NO4/c1-25-20-12-17-19(13-21(20)26-2)27-14-18(22(17)24)15-6-8-16(9-7-15)23-10-4-3-5-11-23/h6-9,12-14H,3-5,10-11H2,1-2H3	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
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304227 (6,7-Dimethoxy-3-[3-(pyrrolidin-1-ylmethyl)-phenyl]...) Show SMILES COc1cc2occ(-c3cccc(c3)N3CCCC3)c(=O)c2cc1OC Show InChI InChI=1S/C21H21NO4/c1-24-19-11-16-18(12-20(19)25-2)26-13-17(21(16)23)14-6-5-7-15(10-14)22-8-3-4-9-22/h5-7,10-13H,3-4,8-9H2,1-2H3	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
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304234 (3-{3-[(Diethylamino)-methyl]-phenyl}-6,7-dimethoxy...) Show SMILES CCN(CC)c1cccc(c1)-c1coc2cc(OC)c(OC)cc2c1=O Show InChI InChI=1S/C21H23NO4/c1-5-22(6-2)15-9-7-8-14(10-15)17-13-26-18-12-20(25-4)19(24-3)11-16(18)21(17)23/h7-13H,5-6H2,1-4H3	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
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304235 (3-{4-[(Diethylamino)-methyl]-phenyl}-6,7-dimethoxy...) Show SMILES CCN(CC)c1ccc(cc1)-c1coc2cc(OC)c(OC)cc2c1=O Show InChI InChI=1S/C21H23NO4/c1-5-22(6-2)15-9-7-14(8-10-15)17-13-26-18-12-20(25-4)19(24-3)11-16(18)21(17)23/h7-13H,5-6H2,1-4H3	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
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304242 (6,7-Dimethoxy-2-[3-(pyrrolidin-1-ylmethyl)-phenyl]...) Show SMILES COc1cc2OC(CC(=O)c2cc1OC)c1cccc(c1)N1CCCC1 Show InChI InChI=1S/C21H23NO4/c1-24-20-11-16-17(23)12-18(26-19(16)13-21(20)25-2)14-6-5-7-15(10-14)22-8-3-4-9-22/h5-7,10-11,13,18H,3-4,8-9,12H2,1-2H3	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
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304244 (2-{3-[(Diethylamino)-methyl]-phenyl}-6,7-dimethoxy...) Show SMILES CCN(CC)c1cccc(c1)C1CC(=O)c2cc(OC)c(OC)cc2O1 Show InChI InChI=1S/C21H25NO4/c1-5-22(6-2)15-9-7-8-14(10-15)18-12-17(23)16-11-20(24-3)21(25-4)13-19(16)26-18/h7-11,13,18H,5-6,12H2,1-4H3	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
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304241 (2-{4-[(Diethylamino)-methyl]-phenyl}-6,7-dimethoxy...) Show SMILES CCN(CC)c1ccc(cc1)C1CC(=O)c2cc(OC)c(OC)cc2O1 Show InChI InChI=1S/C21H25NO4/c1-5-22(6-2)15-9-7-14(8-10-15)18-12-17(23)16-11-20(24-3)21(25-4)13-19(16)26-18/h7-11,13,18H,5-6,12H2,1-4H3	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
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304240 (6,7-Dimethoxy-2-{4-[(ethylmethylamino)-methyl]-phe...) Show SMILES CCN(C)c1ccc(cc1)C1CC(=O)c2cc(OC)c(OC)cc2O1 Show InChI InChI=1S/C20H23NO4/c1-5-21(2)14-8-6-13(7-9-14)17-11-16(22)15-10-19(23-3)20(24-4)12-18(15)25-17/h6-10,12,17H,5,11H2,1-4H3	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
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304243 (2-{3-[(Diethylamino)-methyl]-phenyl}-6,7-dimethoxy...) Show SMILES CCN(CC)c1cccc(c1)-c1cc(=O)c2cc(OC)c(OC)cc2o1 Show InChI InChI=1S/C21H23NO4/c1-5-22(6-2)15-9-7-8-14(10-15)18-12-17(23)16-11-20(24-3)21(25-4)13-19(16)26-18/h7-13H,5-6H2,1-4H3	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
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304233 (6,7-Dimethoxy-2-{4-[(ethylmethylamino)-methyl)-phe...) Show SMILES CCN(C)c1ccc(cc1)-c1cc(=O)c2cc(OC)c(OC)cc2o1 Show InChI InChI=1S/C20H21NO4/c1-5-21(2)14-8-6-13(7-9-14)17-11-16(22)15-10-19(23-3)20(24-4)12-18(15)25-17/h6-12H,5H2,1-4H3	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
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304229 ((E)-1-(2-Hydroxy-4,5-dimethoxyphenyl)-3-[4-(piperi...) Show SMILES COc1cc(O)c(cc1OC)C(=O)\C=C\c1ccc(cc1)N1CCCCC1 Show InChI InChI=1S/C22H25NO4/c1-26-21-14-18(20(25)15-22(21)27-2)19(24)11-8-16-6-9-17(10-7-16)23-12-4-3-5-13-23/h6-11,14-15,25H,3-5,12-13H2,1-2H3/b11-8+	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
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304249 ((E)-1-(2-Hydroxy-4,5-dimethoxyphenyl)-3-[4-(pyrrol...) Show SMILES COc1cc(O)c(cc1OC)C(=O)\C=C\c1ccc(cc1)N1CCCC1 Show InChI InChI=1S/C21H23NO4/c1-25-20-13-17(19(24)14-21(20)26-2)18(23)10-7-15-5-8-16(9-6-15)22-11-3-4-12-22/h5-10,13-14,24H,3-4,11-12H2,1-2H3/b10-7+	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
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304239 ((E)-3-{3-[(Diethylamino)-methyl]-phenyl}-1-(2-hydr...) Show SMILES CCN(CC)c1cccc(\C=C\C(=O)c2cc(OC)c(OC)cc2O)c1 Show InChI InChI=1S/C21H25NO4/c1-5-22(6-2)16-9-7-8-15(12-16)10-11-18(23)17-13-20(25-3)21(26-4)14-19(17)24/h7-14,24H,5-6H2,1-4H3/b11-10+	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
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304228 ((E)-3-{4-[(Diethylamino)-methyl]-phenyl}-1-(2-hydr...) Show SMILES CCN(CC)c1ccc(\C=C\C(=O)c2cc(OC)c(OC)cc2O)cc1 Show InChI InChI=1S/C21H25NO4/c1-5-22(6-2)16-10-7-15(8-11-16)9-12-18(23)17-13-20(25-3)21(26-4)14-19(17)24/h7-14,24H,5-6H2,1-4H3/b12-9+	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
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Rattus norvegicus (rat))	BDBM50304230 ((E)-3-{4-[(Ethylmethylamino)-methyl]-phenyl}-1-(2-...) Show SMILES CCN(C)c1ccc(\C=C\C(=O)c2cc(OC)c(OC)cc2O)cc1 Show InChI InChI=1S/C20H23NO4/c1-5-21(2)15-9-6-14(7-10-15)8-11-17(22)16-12-19(24-3)20(25-4)13-18(16)23/h6-13,23H,5H2,1-4H3/b11-8+	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
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of BChE in rat serum after 15 mins by modified Ellman's method				Bioorg Med Chem 17: 6692-8 (2009) Article DOI: 10.1016/j.bmc.2009.07.072 BindingDB Entry DOI: 10.7270/Q29S1R4M
					More data for this Ligand-Target Pair

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