Compile Data Set for Download or QSAR

Found 21 hits with Last Name = 'tsai' and Initial = 'sf'   

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))	BDBM50292332 (2,3,9,10-Tetramethoxy-5,6-dihydro-isoquino[3,2-a]i...) Show SMILES COc1cc2CC[n+]3cc4c(OC)c(OC)ccc4cc3-c2cc1OC Show InChI InChI=1S/C21H22NO4/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4/h5-6,9-12H,7-8H2,1-4H3/q+1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50328694 (CHEMBL1270850 | pseudopalmatine trifluoroacetate) Show SMILES COc1cc2CC[n+]3cc4cc(OC)c(OC)cc4cc3-c2cc1OC Show InChI InChI=1S/C21H22NO4/c1-23-18-8-13-5-6-22-12-15-10-20(25-3)19(24-2)9-14(15)7-17(22)16(13)11-21(18)26-4/h7-12H,5-6H2,1-4H3/q+1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM10404 ((1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetrac...) Show SMILES COc1ccc2CN(C)CC[C@@]34C=C[C@H](O)C[C@@H]3Oc1c24 |r,c:12| Show InChI InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50328690 (CHEMBL1270646 | pseudocolumbamine trifluoroacetate) Show SMILES COc1cc2CC[n+]3cc4cc(OC)c(OC)cc4cc3-c2cc1O Show InChI InChI=1S/C20H19NO4/c1-23-18-7-12-4-5-21-11-14-9-20(25-3)19(24-2)8-13(14)6-16(21)15(12)10-17(18)22/h6-11H,4-5H2,1-3H3/p+1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50328681 ((7S,14S)-(-)-7-Methyl-10-O-demethylxylopinine trif...) Show SMILES COc1cc2C[C@H]3c4cc(OC)c(OC)cc4CC[N@@+]3(C)Cc2cc1O |r| Show InChI InChI=1S/C21H25NO4/c1-22-6-5-13-9-20(25-3)21(26-4)11-16(13)17(22)7-14-10-19(24-2)18(23)8-15(14)12-22/h8-11,17H,5-7,12H2,1-4H3/p+1/t17-,22-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50328679 (7-hydroxy-6-methoxy-2-methyl-3,4-dihydroisoquinoli...) Show SMILES COc1cc2CC[N+](C)=Cc2cc1O |c:8| Show InChI InChI=1S/C11H13NO2/c1-12-4-3-8-6-11(14-2)10(13)5-9(8)7-12/h5-7H,3-4H2,1-2H3/p+1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50292452 ((+)-ushinsunine-beta-N-oxide | CHEMBL510090 | Lysi...) Show SMILES COc1cc2ccnc3C(=O)c4ccccc4-c(c1OC)c23 Show InChI InChI=1S/C18H13NO3/c1-21-13-9-10-7-8-19-16-14(10)15(18(13)22-2)11-5-3-4-6-12(11)17(16)20/h3-9H,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.61E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50328695 (5-O-Methylmarcanine D | CHEMBL1269160) Show SMILES COc1cccc2C(=O)c3[nH]c(=O)cc(C)c3C(=O)c12 Show InChI InChI=1S/C15H11NO4/c1-7-6-10(17)16-13-11(7)15(19)12-8(14(13)18)4-3-5-9(12)20-2/h3-6H,1-2H3,(H,16,17)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.34E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50328689 (CHEMBL1270645 | S-(-)-7,8-didehydrocorydalminium s...) Show SMILES COc1cc2CC[N+]3=Cc4c(C[C@H]3c2cc1OC)ccc(O)c4OC |r,t:7| Show InChI InChI=1S/C20H21NO4/c1-23-18-9-13-6-7-21-11-15-12(4-5-17(22)20(15)25-3)8-16(21)14(13)10-19(18)24-2/h4-5,9-11,16H,6-8H2,1-3H3/p+1/t16-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.08E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50328680 ((+)-reticuline trifluoroacetate | CHEMBL1270151) Show SMILES COc1ccc(C[C@@H]2[NH+](C)CCc3cc(OC)c(O)cc23)cc1O |r| Show InChI InChI=1S/C19H23NO4/c1-20-7-6-13-10-19(24-3)17(22)11-14(13)15(20)8-12-4-5-18(23-2)16(21)9-12/h4-5,9-11,15,21-22H,6-8H2,1-3H3/p+1/t15-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.22E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50328686 (CHEMBL1270450 | S-(+)-3-hydroxynornantenine triflu...) Show SMILES COc1c(O)c2CC[NH2+][C@H]3Cc4cc5OCOc5cc4-c(c1OC)c23 |r| Show InChI InChI=1S/C19H19NO5/c1-22-18-16-11-7-14-13(24-8-25-14)6-9(11)5-12-15(16)10(3-4-20-12)17(21)19(18)23-2/h6-7,12,20-21H,3-5,8H2,1-2H3/p+1/t12-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.69E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50328691 (CHEMBL1270747 | dehydrocorydalmine trifluoroacetat...) Show SMILES COc1cc2CC[n+]3cc4c(OC)c(O)ccc4cc3-c2cc1OC Show InChI InChI=1S/C20H19NO4/c1-23-18-9-13-6-7-21-11-15-12(4-5-17(22)20(15)25-3)8-16(21)14(13)10-19(18)24-2/h4-5,8-11H,6-7H2,1-3H3/p+1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.65E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50328692 (CHEMBL1270748 | dehydrocorytenchine trifluoroaceta...) Show SMILES COc1cc2CCn3cc4cc(OC)c(=[OH+])cc4cc3-c2cc1OC Show InChI InChI=1S/C20H19NO4/c1-23-18-9-14-11-21-5-4-12-8-19(24-2)20(25-3)10-15(12)16(21)6-13(14)7-17(18)22/h6-11H,4-5H2,1-3H3/p+1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.76E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50328687 (CHEMBL1270547 | R-(-)-3-hydroxynornuciferine trifl...) Show SMILES COc1c(O)c2CC[NH2+][C@@H]3Cc4ccccc4-c(c1OC)c23 |r| Show InChI InChI=1S/C18H19NO3/c1-21-17-15-11-6-4-3-5-10(11)9-13-14(15)12(7-8-19-13)16(20)18(17)22-2/h3-6,13,19-20H,7-9H2,1-2H3/p+1/t13-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+5	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50328684 (CHEMBL1270355 | R-(-)-actinodaphnine trifluoroacet...) Show SMILES COc1cc-2c(C[C@H]3[NH2+]CCc4cc5OCOc5c-2c34)cc1O |r| Show InChI InChI=1S/C18H17NO4/c1-21-14-7-11-10(5-13(14)20)4-12-16-9(2-3-19-12)6-15-18(17(11)16)23-8-22-15/h5-7,12,19-20H,2-4,8H2,1H3/p+1/t12-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.17E+5	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50328683 (CHEMBL1270354 | R-(-)-asimilobine trifluoroacetate) Show SMILES COc1c(O)cc2CC[NH2+][C@@H]3Cc4ccccc4-c1c23 |r| Show InChI InChI=1S/C17H17NO2/c1-20-17-14(19)9-11-6-7-18-13-8-10-4-2-3-5-12(10)16(17)15(11)13/h2-5,9,13,18-19H,6-8H2,1H3/p+1/t13-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.23E+5	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50328685 (CHEMBL1270449 | R-(-)-norushinsunine trifluoroacet...) Show SMILES O[C@H]1[C@@H]2[NH2+]CCc3cc4OCOc4c(-c4ccccc14)c23 |r| Show InChI InChI=1S/C17H15NO3/c19-16-11-4-2-1-3-10(11)14-13-9(5-6-18-15(13)16)7-12-17(14)21-8-20-12/h1-4,7,15-16,18-19H,5-6,8H2/p+1/t15-,16-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.26E+5	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50328682 (CHEMBL1270256 | S-(+)-N-methylcorydine trifluoroac...) Show SMILES COc1ccc2C[C@H]3c4c(CC[N+]3(C)C)cc(OC)c(O)c4-c2c1OC |r| Show InChI InChI=1S/C21H25NO4/c1-22(2)9-8-13-11-16(25-4)20(23)19-17(13)14(22)10-12-6-7-15(24-3)21(26-5)18(12)19/h6-7,11,14H,8-10H2,1-5H3/p+1/t14-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.40E+5	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50202301 (CHEMBL37736 | Liriodenine | hiriodenine) Show SMILES O=C1c2ccccc2-c2c3OCOc3cc3ccnc1c23 Show InChI InChI=1S/C17H9NO3/c19-16-11-4-2-1-3-10(11)14-13-9(5-6-18-15(13)16)7-12-17(14)21-8-20-12/h1-7H,8H2	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50328696 (1,2-Dimethoxy-9,11-dioxa-6-aza-benzo[fg]cyclopenta...) Show SMILES COc1cc2ccnc3C(=O)c4cc5OCOc5cc4-c(c1OC)c23 Show InChI InChI=1S/C19H13NO5/c1-22-14-5-9-3-4-20-17-15(9)16(19(14)23-2)10-6-12-13(25-8-24-12)7-11(10)18(17)21/h3-7H,8H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50328688 (CHEMBL1270548 | S-(-)-7,8-Didehydro-10-O-demethylx...) Show SMILES COc1cc2C[C@H]3c4cc(OC)c(OC)cc4CC[N+]3=Cc2cc1O |r,c:21| Show InChI InChI=1S/C20H21NO4/c1-23-18-9-13-6-16-15-10-20(25-3)19(24-2)8-12(15)4-5-21(16)11-14(13)7-17(18)22/h7-11,16H,4-6H2,1-3H3/p+1/t16-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.54E+5	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Nat Prod (2010) Article DOI: 10.1021/np100247r BindingDB Entry DOI: 10.7270/Q2HH6M22
					More data for this Ligand-Target Pair