Compile Data Set for Download or QSAR

Found 73 hits with Last Name = 'murray' and Initial = 'ap'   

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 (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050693 (CHEMBL3311539) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCN3CCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C28H49NO3/c1-22(20-26(31)32-19-8-7-18-29-16-5-6-17-29)10-12-24-23(21-30)11-13-25-27(2,3)14-9-15-28(24,25)4/h11,22,24-25,30H,5-10,12-21H2,1-4H3/t22-,24-,25-,28+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Mixed type inhibition of Torpedo californica AChE by Lineweaver-Burk plot				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50019010 (CHEMBL3288082) Show SMILES [Na+].[Na+].[H][C@]12[C@@H](CC[C@]1(C)[C@H](C[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](OS([O-])(=O)=O)C(C)(C)[C@]3([H])CC[C@@]12C)OS([O-])(=O)=O)C(C)C |r| Show InChI InChI=1S/C30H52O8S2.2Na/c1-18(2)19-11-14-28(6)24(38-40(34,35)36)17-30(8)20(25(19)28)9-10-22-27(5)15-13-23(37-39(31,32)33)26(3,4)21(27)12-16-29(22,30)7;;/h18-25H,9-17H2,1-8H3,(H,31,32,33)(H,34,35,36);;/q;2*+1/p-2/t19-,20+,21-,22+,23-,24-,25+,27-,28+,29+,30+;;/m0../s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.44E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Uncompetitive inhibition of Pacific electric ray AChE using acetylthiocholine as substrate by Lineweaver-Burk plot analysis				Bioorg Med Chem 22: 3341-50 (2014) Article DOI: 10.1016/j.bmc.2014.04.050 BindingDB Entry DOI: 10.7270/Q28P6220
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	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 UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair				3D Structure (crystal)
Cholinesterase (Equus caballus (Horse))	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 UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of BChE in horse serum using butyrylthiocholine iodide as substrate after 120 mins by Ellman's method				Bioorg Med Chem 22: 3341-50 (2014) Article DOI: 10.1016/j.bmc.2014.04.050 BindingDB Entry DOI: 10.7270/Q28P6220
					More data for this Ligand-Target Pair				3D Structure (crystal)
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	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 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
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Pacific electric ray AChE using acetylthiocholine iodide as substrate after 60 mins by Ellman's method				Bioorg Med Chem 22: 3341-50 (2014) Article DOI: 10.1016/j.bmc.2014.04.050 BindingDB Entry DOI: 10.7270/Q28P6220
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	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 UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of BChE in horse serum using butyrylthiocholine iodide as substrate after 120 mins by Ellman's method				Bioorg Med Chem 22: 3341-50 (2014) Article DOI: 10.1016/j.bmc.2014.04.050 BindingDB Entry DOI: 10.7270/Q28P6220
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	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 UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	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 UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Pacific electric ray AChE using acetylthiocholine iodide as substrate after 60 mins by Ellman's method				Bioorg Med Chem 22: 3341-50 (2014) Article DOI: 10.1016/j.bmc.2014.04.050 BindingDB Entry DOI: 10.7270/Q28P6220
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050693 (CHEMBL3311539) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCN3CCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C28H49NO3/c1-22(20-26(31)32-19-8-7-18-29-16-5-6-17-29)10-12-24-23(21-30)11-13-25-27(2,3)14-9-15-28(24,25)4/h11,22,24-25,30H,5-10,12-21H2,1-4H3/t22-,24-,25-,28+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050692 (CHEMBL3311540) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCCN3CCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C29H51NO3/c1-23(21-27(32)33-20-9-5-6-17-30-18-7-8-19-30)11-13-25-24(22-31)12-14-26-28(2,3)15-10-16-29(25,26)4/h12,23,25-26,31H,5-11,13-22H2,1-4H3/t23-,25-,26-,29+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050569 (CHEMBL3311548) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCN3CCCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C28H49NO3/c1-22(20-26(31)32-19-9-18-29-16-6-5-7-17-29)10-12-24-23(21-30)11-13-25-27(2,3)14-8-15-28(24,25)4/h11,22,24-25,30H,5-10,12-21H2,1-4H3/t22-,24-,25-,28+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050573 (CHEMBL3311544) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCN(CC)CC)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C28H51NO3/c1-7-29(8-2)18-9-10-19-32-26(31)20-22(3)12-14-24-23(21-30)13-15-25-27(4,5)16-11-17-28(24,25)6/h13,22,24-25,30H,7-12,14-21H2,1-6H3/t22-,24-,25-,28+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050693 (CHEMBL3311539) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCN3CCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C28H49NO3/c1-22(20-26(31)32-19-8-7-18-29-16-5-6-17-29)10-12-24-23(21-30)11-13-25-27(2,3)14-9-15-28(24,25)4/h11,22,24-25,30H,5-10,12-21H2,1-4H3/t22-,24-,25-,28+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050566 (CHEMBL3309346) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCCCN3CCCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C31H55NO3/c1-25(23-29(34)35-22-11-6-5-8-19-32-20-9-7-10-21-32)13-15-27-26(24-33)14-16-28-30(2,3)17-12-18-31(27,28)4/h14,25,27-28,33H,5-13,15-24H2,1-4H3/t25-,27-,28-,31+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.05E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050691 (CHEMBL3311541) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCCCN3CCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C30H53NO3/c1-24(22-28(33)34-21-10-6-5-7-18-31-19-8-9-20-31)12-14-26-25(23-32)13-15-27-29(2,3)16-11-17-30(26,27)4/h13,24,26-27,32H,5-12,14-23H2,1-4H3/t24-,26-,27-,30+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.06E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050689 (CHEMBL3311543) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCN(CC)CC)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C27H49NO3/c1-7-28(8-2)17-10-18-31-25(30)19-21(3)11-13-23-22(20-29)12-14-24-26(4,5)15-9-16-27(23,24)6/h12,21,23-24,29H,7-11,13-20H2,1-6H3/t21-,23-,24-,27+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.18E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050691 (CHEMBL3311541) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCCCN3CCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C30H53NO3/c1-24(22-28(33)34-21-10-6-5-7-18-31-19-8-9-20-31)12-14-26-25(23-32)13-15-27-29(2,3)16-11-17-30(26,27)4/h13,24,26-27,32H,5-12,14-23H2,1-4H3/t24-,26-,27-,30+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.35E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050572 (CHEMBL3311545) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCCN(CC)CC)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C29H53NO3/c1-7-30(8-2)19-10-9-11-20-33-27(32)21-23(3)13-15-25-24(22-31)14-16-26-28(4,5)17-12-18-29(25,26)6/h14,23,25-26,31H,7-13,15-22H2,1-6H3/t23-,25-,26-,29+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.38E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050566 (CHEMBL3309346) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCCCN3CCCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C31H55NO3/c1-25(23-29(34)35-22-11-6-5-8-19-32-20-9-7-10-21-32)13-15-27-26(24-33)14-16-28-30(2,3)17-12-18-31(27,28)4/h14,25,27-28,33H,5-13,15-24H2,1-4H3/t25-,27-,28-,31+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.45E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050567 (CHEMBL3311550) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCCN3CCCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C30H53NO3/c1-24(22-28(33)34-21-10-6-9-20-31-18-7-5-8-19-31)12-14-26-25(23-32)13-15-27-29(2,3)16-11-17-30(26,27)4/h13,24,26-27,32H,5-12,14-23H2,1-4H3/t24-,26-,27-,30+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.47E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050568 (CHEMBL3311549) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCN3CCCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C29H51NO3/c1-23(21-27(32)33-20-9-8-19-30-17-6-5-7-18-30)11-13-25-24(22-31)12-14-26-28(2,3)15-10-16-29(25,26)4/h12,23,25-26,31H,5-11,13-22H2,1-4H3/t23-,25-,26-,29+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050571 (CHEMBL3311546) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCCCN(CC)CC)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C30H55NO3/c1-7-31(8-2)20-11-9-10-12-21-34-28(33)22-24(3)14-16-26-25(23-32)15-17-27-29(4,5)18-13-19-30(26,27)6/h15,24,26-27,32H,7-14,16-23H2,1-6H3/t24-,26-,27-,30+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.52E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050695 (CHEMBL3311457) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCN3CCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C26H45NO3/c1-20(18-24(29)30-17-16-27-14-5-6-15-27)8-10-22-21(19-28)9-11-23-25(2,3)12-7-13-26(22,23)4/h9,20,22-23,28H,5-8,10-19H2,1-4H3/t20-,22-,23-,26+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050571 (CHEMBL3311546) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCCCN(CC)CC)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C30H55NO3/c1-7-31(8-2)20-11-9-10-12-21-34-28(33)22-24(3)14-16-26-25(23-32)15-17-27-29(4,5)18-13-19-30(26,27)6/h15,24,26-27,32H,7-14,16-23H2,1-6H3/t24-,26-,27-,30+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.78E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050689 (CHEMBL3311543) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCN(CC)CC)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C27H49NO3/c1-7-28(8-2)17-10-18-31-25(30)19-21(3)11-13-23-22(20-29)12-14-24-26(4,5)15-9-16-27(23,24)6/h12,21,23-24,29H,7-11,13-20H2,1-6H3/t21-,23-,24-,27+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.81E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050696 (CHEMBL3311456) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(O)=O)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C20H34O3/c1-14(12-18(22)23)6-8-16-15(13-21)7-9-17-19(2,3)10-5-11-20(16,17)4/h7,14,16-17,21H,5-6,8-13H2,1-4H3,(H,22,23)/t14-,16-,17-,20+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.11E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50019013 (CHEMBL3288094) Show SMILES [H][C@]12[C@@H](CC[C@]1(C)C(=O)C[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CCC(=O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=C)C=O |r| Show InChI InChI=1S/C30H44O3/c1-18(17-31)19-10-13-28(5)24(33)16-30(7)20(25(19)28)8-9-22-27(4)14-12-23(32)26(2,3)21(27)11-15-29(22,30)6/h17,19-22,25H,1,8-16H2,2-7H3/t19-,20+,21-,22+,25+,27-,28+,29+,30+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.15E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of BChE in horse serum using butyrylthiocholine iodide as substrate after 120 mins by Ellman's method				Bioorg Med Chem 22: 3341-50 (2014) Article DOI: 10.1016/j.bmc.2014.04.050 BindingDB Entry DOI: 10.7270/Q28P6220
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050692 (CHEMBL3311540) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCCN3CCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C29H51NO3/c1-23(21-27(32)33-20-9-5-6-17-30-18-7-8-19-30)11-13-25-24(22-31)12-14-26-28(2,3)15-10-16-29(25,26)4/h12,23,25-26,31H,5-11,13-22H2,1-4H3/t23-,25-,26-,29+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.21E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050573 (CHEMBL3311544) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCN(CC)CC)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C28H51NO3/c1-7-29(8-2)18-9-10-19-32-26(31)20-22(3)12-14-24-23(21-30)13-15-25-27(4,5)16-11-17-28(24,25)6/h13,22,24-25,30H,7-12,14-21H2,1-6H3/t22-,24-,25-,28+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.36E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050567 (CHEMBL3311550) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCCN3CCCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C30H53NO3/c1-24(22-28(33)34-21-10-6-9-20-31-18-7-5-8-19-31)12-14-26-25(23-32)13-15-27-29(2,3)16-11-17-30(26,27)4/h13,24,26-27,32H,5-12,14-23H2,1-4H3/t24-,26-,27-,30+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.48E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050572 (CHEMBL3311545) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCCN(CC)CC)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C29H53NO3/c1-7-30(8-2)19-10-9-11-20-33-27(32)21-23(3)13-15-25-24(22-31)14-16-26-28(4,5)17-12-18-29(25,26)6/h14,23,25-26,31H,7-13,15-22H2,1-6H3/t23-,25-,26-,29+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.72E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050694 (CHEMBL3311458) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCN3CCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C27H47NO3/c1-21(19-25(30)31-18-8-17-28-15-5-6-16-28)9-11-23-22(20-29)10-12-24-26(2,3)13-7-14-27(23,24)4/h10,21,23-24,29H,5-9,11-20H2,1-4H3/t21-,23-,24-,27+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.38E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050569 (CHEMBL3311548) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCN3CCCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C28H49NO3/c1-22(20-26(31)32-19-9-18-29-16-6-5-7-17-29)10-12-24-23(21-30)11-13-25-27(2,3)14-8-15-28(24,25)4/h11,22,24-25,30H,5-10,12-21H2,1-4H3/t22-,24-,25-,28+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.47E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050568 (CHEMBL3311549) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCN3CCCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C29H51NO3/c1-23(21-27(32)33-20-9-8-19-30-17-6-5-7-18-30)11-13-25-24(22-31)12-14-26-28(2,3)15-10-16-29(25,26)4/h12,23,25-26,31H,5-11,13-22H2,1-4H3/t23-,25-,26-,29+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.71E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050690 (CHEMBL3311542) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCN(CC)CC)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C26H47NO3/c1-7-27(8-2)16-17-30-24(29)18-20(3)10-12-22-21(19-28)11-13-23-25(4,5)14-9-15-26(22,23)6/h11,20,22-23,28H,7-10,12-19H2,1-6H3/t20-,22-,23-,26+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.99E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050694 (CHEMBL3311458) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCN3CCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C27H47NO3/c1-21(19-25(30)31-18-8-17-28-15-5-6-16-28)9-11-23-22(20-29)10-12-24-26(2,3)13-7-14-27(23,24)4/h10,21,23-24,29H,5-9,11-20H2,1-4H3/t21-,23-,24-,27+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.38E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050565 (CHEMBL3309347) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCN3CCOCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C26H45NO4/c1-20(18-24(29)31-17-14-27-12-15-30-16-13-27)6-8-22-21(19-28)7-9-23-25(2,3)10-5-11-26(22,23)4/h7,20,22-23,28H,5-6,8-19H2,1-4H3/t20-,22-,23-,26+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050564 (CHEMBL3309348) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCN3CCOCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C27H47NO4/c1-21(19-25(30)32-16-6-13-28-14-17-31-18-15-28)7-9-23-22(20-29)8-10-24-26(2,3)11-5-12-27(23,24)4/h8,21,23-24,29H,5-7,9-20H2,1-4H3/t21-,23-,24-,27+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050563 (CHEMBL3309349) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCN3CCOCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C28H49NO4/c1-22(20-26(31)33-17-6-5-14-29-15-18-32-19-16-29)8-10-24-23(21-30)9-11-25-27(2,3)12-7-13-28(24,25)4/h9,22,24-25,30H,5-8,10-21H2,1-4H3/t22-,24-,25-,28+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050562 (CHEMBL3309350) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCCN3CCOCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C29H51NO4/c1-23(21-27(32)34-18-7-5-6-15-30-16-19-33-20-17-30)9-11-25-24(22-31)10-12-26-28(2,3)13-8-14-29(25,26)4/h10,23,25-26,31H,5-9,11-22H2,1-4H3/t23-,25-,26-,29+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050561 (CHEMBL3309351) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCCCN3CCOCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C30H53NO4/c1-24(22-28(33)35-19-8-6-5-7-16-31-17-20-34-21-18-31)10-12-26-25(23-32)11-13-27-29(2,3)14-9-15-30(26,27)4/h11,24,26-27,32H,5-10,12-23H2,1-4H3/t24-,26-,27-,30+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050570 (CHEMBL3311547) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCN3CCCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C27H47NO3/c1-21(19-25(30)31-18-17-28-15-6-5-7-16-28)9-11-23-22(20-29)10-12-24-26(2,3)13-8-14-27(23,24)4/h10,21,23-24,29H,5-9,11-20H2,1-4H3/t21-,23-,24-,27+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050690 (CHEMBL3311542) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCN(CC)CC)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C26H47NO3/c1-7-27(8-2)16-17-30-24(29)18-20(3)10-12-22-21(19-28)11-13-23-25(4,5)14-9-15-26(22,23)6/h11,20,22-23,28H,7-10,12-19H2,1-6H3/t20-,22-,23-,26+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50050695 (CHEMBL3311457) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCN3CCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C26H45NO3/c1-20(18-24(29)30-17-16-27-14-5-6-15-27)8-10-22-21(19-28)9-11-23-25(2,3)12-7-13-26(22,23)4/h9,20,22-23,28H,5-8,10-19H2,1-4H3/t20-,22-,23-,26+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050561 (CHEMBL3309351) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCCCN3CCOCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C30H53NO4/c1-24(22-28(33)35-19-8-6-5-7-16-31-17-20-34-21-18-31)10-12-26-25(23-32)11-13-27-29(2,3)14-9-15-30(26,27)4/h11,24,26-27,32H,5-10,12-23H2,1-4H3/t24-,26-,27-,30+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050562 (CHEMBL3309350) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCCN3CCOCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C29H51NO4/c1-23(21-27(32)34-18-7-5-6-15-30-16-19-33-20-17-30)9-11-25-24(22-31)10-12-26-28(2,3)13-8-14-29(25,26)4/h10,23,25-26,31H,5-9,11-22H2,1-4H3/t23-,25-,26-,29+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050563 (CHEMBL3309349) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCN3CCOCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C28H49NO4/c1-22(20-26(31)33-17-6-5-14-29-15-18-32-19-16-29)8-10-24-23(21-30)9-11-25-27(2,3)12-7-13-28(24,25)4/h9,22,24-25,30H,5-8,10-21H2,1-4H3/t22-,24-,25-,28+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050564 (CHEMBL3309348) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCN3CCOCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C27H47NO4/c1-21(19-25(30)32-16-6-13-28-14-17-31-18-15-28)7-9-23-22(20-29)8-10-24-26(2,3)11-5-12-27(23,24)4/h8,21,23-24,29H,5-7,9-20H2,1-4H3/t21-,23-,24-,27+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050565 (CHEMBL3309347) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCN3CCOCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C26H45NO4/c1-20(18-24(29)31-17-14-27-12-15-30-16-13-27)6-8-22-21(19-28)7-9-23-25(2,3)10-5-11-26(22,23)4/h7,20,22-23,28H,5-6,8-19H2,1-4H3/t20-,22-,23-,26+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50050570 (CHEMBL3311547) Show SMILES [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCN3CCCCC3)[C@@]1(C)CCCC2(C)C |r,t:3| Show InChI InChI=1S/C27H47NO3/c1-21(19-25(30)31-18-17-28-15-6-5-7-16-28)9-11-23-22(20-29)10-12-24-26(2,3)13-8-14-27(23,24)4/h10,21,23-24,29H,5-9,11-20H2,1-4H3/t21-,23-,24-,27+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Nacional del Sur Curated by ChEMBL					Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method				Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC
					More data for this Ligand-Target Pair

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