Compile Data Set for Download or QSAR

Found 741 hits with Last Name = 'bertrand' and Initial = 's'   

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
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Rattus norvegicus (Rat))	BDBM50049757 (()-2-(6-Chloro-pyridin-3-yl)-7-aza-bicyclo[2.2.1]h...) Show SMILES Clc1ccc(cn1)C1CC2CCC1N2 |TLB:4:7:11.10:13| Show InChI InChI=1S/C11H13ClN2/c12-11-4-1-7(6-13-11)9-5-8-2-3-10(9)14-8/h1,4,6,8-10,14H,2-3,5H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars	PubMed	0.180	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Strasbourg BP 24 Curated by ChEMBL					Assay Description In vitro inhibitory potency for preventing ET-1 induced constriction of rat aortic rings (ETA receptor)				Bioorg Med Chem Lett 13: 1001-4 (2003) BindingDB Entry DOI: 10.7270/Q2WW7JV4
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Rattus norvegicus (Rat))	BDBM50125187 (2-(2-Chloro-pyrimidin-5-yl)-7-aza-bicyclo[2.2.1]he...) Show SMILES Clc1ncc(cn1)C1CC2CCC1N2 |THB:4:7:13:11.10| Show InChI InChI=1S/C10H12ClN3/c11-10-12-4-6(5-13-10)8-3-7-1-2-9(8)14-7/h4-5,7-9,14H,1-3H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	0.310	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Strasbourg BP 24 Curated by ChEMBL					Assay Description In vitro inhibitory potency for preventing sarafotoxin S6c induced constriction of rat tracheal rings (ETB receptor)				Bioorg Med Chem Lett 13: 1001-4 (2003) BindingDB Entry DOI: 10.7270/Q2WW7JV4
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7 (Homo sapiens (Human))	BDBM50296742 (1,4-diazabicyclo[3.2.2]nonane-(4-bromo)-phenyl car...) Show SMILES Brc1ccc(OC(=O)N2CCN3CCC2CC3)cc1 |TLB:6:8:13.12:15.16,(1.51,4.96,;.33,3.96,;.6,2.44,;-.59,1.45,;-2.03,1.98,;-3.21,.98,;-4.67,1.51,;-4.94,3.03,;-5.85,.51,;-5.48,-.96,;-6.49,-.24,;-7.87,-.31,;-7.95,1.4,;-7.33,2.56,;-7.26,1.14,;-8.56,.43,;-8.86,-1.01,;-2.31,3.49,;-1.14,4.49,)| Show InChI InChI=1S/C14H17BrN2O2/c15-11-1-3-13(4-2-11)19-14(18)17-10-9-16-7-5-12(17)6-8-16/h1-4,12H,5-10H2	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity to human alpha7 nAChR				ACS Med Chem Lett 1: 422-426 (2010) Article DOI: 10.1021/ml100125f BindingDB Entry DOI: 10.7270/Q29S1RB9
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4/beta-2 (Rattus norvegicus (Rat))	BDBM50125188 (CHEMBL268176 | N-[5-(7-Aza-bicyclo[2.2.1]hept-2-yl...) Show SMILES ClCC(=O)Nc1ccc(cn1)C1CC2CCC1N2 |THB:8:11:17:15.14| Show InChI InChI=1S/C13H16ClN3O/c14-6-13(18)17-12-4-1-8(7-15-12)10-5-9-2-3-11(10)16-9/h1,4,7,9-11,16H,2-3,5-6H2,(H,15,17,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Louis Pasteur Strasbourg BP 24 Curated by ChEMBL					Assay Description In vitro inhibitory potency for preventing ET-1 induced constriction of rat aortic rings (ETA receptor)				Bioorg Med Chem Lett 13: 1001-4 (2003) BindingDB Entry DOI: 10.7270/Q2WW7JV4
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50267844 (3-(10,11-Dihydro-5H-dibenzo[a,d]cyclohepten-5-ylox...) Show SMILES C[N+]1(C)C2CCC1CC(C2)OC1c2ccccc2CCc2ccccc12 Show InChI InChI=1S/C24H30NO/c1-25(2)19-13-14-20(25)16-21(15-19)26-24-22-9-5-3-7-17(22)11-12-18-8-4-6-10-23(18)24/h3-10,19-21,24H,11-16H2,1-2H3/q+1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	63.1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from Lymnaea stagnalis His-tagged AchBP				J Med Chem 52: 2372-83 (2009) Article DOI: 10.1021/jm801400g BindingDB Entry DOI: 10.7270/Q2NK3DXK
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM82070 (CAS_29790-52-1 | NICOTINE-L (BASE) | Nicotine-D sa...) Show SMILES CN1CCC[C@H]1c1cccnc1 |r| Show InChI InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase KEGG PC cid PC sid PDB UniChem Similars	PDB Article PubMed	63.1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from Lymnaea stagnalis His-tagged AchBP				J Med Chem 52: 2372-83 (2009) Article DOI: 10.1021/jm801400g BindingDB Entry DOI: 10.7270/Q2NK3DXK
					More data for this Ligand-Target Pair				3D Structure (crystal)
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50413516 (CHEMBL522249) Show SMILES CN1C2CCC1CC(C2)OC(=O)COC1c2ccccc2CCc2ccccc12 Show InChI InChI=1S/C25H29NO3/c1-26-19-12-13-20(26)15-21(14-19)29-24(27)16-28-25-22-8-4-2-6-17(22)10-11-18-7-3-5-9-23(18)25/h2-9,19-21,25H,10-16H2,1H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from Lymnaea stagnalis His-tagged AchBP				J Med Chem 52: 2372-83 (2009) Article DOI: 10.1021/jm801400g BindingDB Entry DOI: 10.7270/Q2NK3DXK
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50267883 (8-Benzyl-3-(10,11-dihydro-5H-dibenzo[a,d]cyclohept...) Show SMILES C(N1C2CCC1CC(C2)OC1c2ccccc2CCc2ccccc12)c1ccccc1 Show InChI InChI=1S/C29H31NO/c1-2-8-21(9-3-1)20-30-24-16-17-25(30)19-26(18-24)31-29-27-12-6-4-10-22(27)14-15-23-11-5-7-13-28(23)29/h1-13,24-26,29H,14-20H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from Lymnaea stagnalis His-tagged AchBP				J Med Chem 52: 2372-83 (2009) Article DOI: 10.1021/jm801400g BindingDB Entry DOI: 10.7270/Q2NK3DXK
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50413513 (CHEMBL452172) Show SMILES CCN1C2CCC1CC(C2)OC1c2ccccc2CCc2ccccc12 Show InChI InChI=1S/C24H29NO/c1-2-25-19-13-14-20(25)16-21(15-19)26-24-22-9-5-3-7-17(22)11-12-18-8-4-6-10-23(18)24/h3-10,19-21,24H,2,11-16H2,1H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	126	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from Lymnaea stagnalis His-tagged AchBP				J Med Chem 52: 2372-83 (2009) Article DOI: 10.1021/jm801400g BindingDB Entry DOI: 10.7270/Q2NK3DXK
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50413514 (CHEMBL522981) Show SMILES CN1C2CCC1CC(C2)OC1c2ccccc2CCc2ccc(C)cc12 Show InChI InChI=1S/C24H29NO/c1-16-7-8-18-10-9-17-5-3-4-6-22(17)24(23(18)13-16)26-21-14-19-11-12-20(15-21)25(19)2/h3-8,13,19-21,24H,9-12,14-15H2,1-2H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	126	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from Lymnaea stagnalis His-tagged AchBP				J Med Chem 52: 2372-83 (2009) Article DOI: 10.1021/jm801400g BindingDB Entry DOI: 10.7270/Q2NK3DXK
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419188 (CHEMBL1616460) Show SMILES C(N1CCCC1)c1ccccc1Sc1ccccc1 Show InChI InChI=1S/C17H19NS/c1-2-9-16(10-3-1)19-17-11-5-4-8-15(17)14-18-12-6-7-13-18/h1-5,8-11H,6-7,12-14H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM82070 (CAS_29790-52-1 | NICOTINE-L (BASE) | Nicotine-D sa...) Show SMILES CN1CCC[C@H]1c1cccnc1 |r| Show InChI InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase KEGG PC cid PC sid PDB UniChem Similars	PDB Article PubMed	316	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair				3D Structure (crystal)
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50413509 (CHEMBL523130) Show SMILES C1CC2CC(CC1N2)OC1c2ccccc2CCc2ccccc12 Show InChI InChI=1S/C22H25NO/c1-3-7-20-15(5-1)9-10-16-6-2-4-8-21(16)22(20)24-19-13-17-11-12-18(14-19)23-17/h1-8,17-19,22-23H,9-14H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	316	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from Lymnaea stagnalis His-tagged AchBP				J Med Chem 52: 2372-83 (2009) Article DOI: 10.1021/jm801400g BindingDB Entry DOI: 10.7270/Q2NK3DXK
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419176 (CHEMBL1831027) Show SMILES Cc1ccccc1C(OCCN1CCCCC1)c1ccccc1 Show InChI InChI=1S/C21H27NO/c1-18-10-6-7-13-20(18)21(19-11-4-2-5-12-19)23-17-16-22-14-8-3-9-15-22/h2,4-7,10-13,21H,3,8-9,14-17H2,1H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	316	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50413519 (CHEMBL491860) Show SMILES CN1C2CCC1CC(C2)OC1c2ccccc2CCc2c(C)cccc12 Show InChI InChI=1S/C24H29NO/c1-16-6-5-9-23-21(16)13-10-17-7-3-4-8-22(17)24(23)26-20-14-18-11-12-19(15-20)25(18)2/h3-9,18-20,24H,10-15H2,1-2H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	316	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from Lymnaea stagnalis His-tagged AchBP				J Med Chem 52: 2372-83 (2009) Article DOI: 10.1021/jm801400g BindingDB Entry DOI: 10.7270/Q2NK3DXK
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419186 (CHEMBL1545942) Show SMILES OCCc1c([nH]c2ccccc12)C1CC2CCN1CC2C=C |THB:20:19:12.13:16.15,4:12:19.18:16.15| Show InChI InChI=1S/C19H24N2O/c1-2-13-12-21-9-7-14(13)11-18(21)19-16(8-10-22)15-5-3-4-6-17(15)20-19/h2-6,13-14,18,20,22H,1,7-12H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	398	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50413520 (CHEMBL503237) Show SMILES CN1C2CCC1CC(C2)OC1c2ccccc2CCc2ccccc12 Show InChI InChI=1S/C23H27NO/c1-24-18-12-13-19(24)15-20(14-18)25-23-21-8-4-2-6-16(21)10-11-17-7-3-5-9-22(17)23/h2-9,18-20,23H,10-15H2,1H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	398	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from Lymnaea stagnalis His-tagged AchBP				J Med Chem 52: 2372-83 (2009) Article DOI: 10.1021/jm801400g BindingDB Entry DOI: 10.7270/Q2NK3DXK
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419198 (CHEMBL1828843) Show SMILES CC1(C)CC(=CC(C)(C)N1)c1cc(Br)c(s1)C1=CC(C)(C)NC(C)(C)C1 |c:4,t:18| Show InChI InChI=1S/C22H33BrN2S/c1-19(2)10-14(11-20(3,4)24-19)17-9-16(23)18(26-17)15-12-21(5,6)25-22(7,8)13-15/h9-10,12,24-25H,11,13H2,1-8H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	398	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419180 (CHEMBL1831037) Show SMILES Cc1ccc(cc1)C(OCC1CCC[N+](C)(C)C1)c1ccccc1 Show InChI InChI=1S/C22H30NO/c1-18-11-13-21(14-12-18)22(20-9-5-4-6-10-20)24-17-19-8-7-15-23(2,3)16-19/h4-6,9-14,19,22H,7-8,15-17H2,1-3H3/q+1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	501	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419190 (CHEMBL1828844) Show SMILES O=C1COc2ccccc2N1CCCCN1CCc2ccccc2C1 Show InChI InChI=1S/C21H24N2O2/c24-21-16-25-20-10-4-3-9-19(20)23(21)13-6-5-12-22-14-11-17-7-1-2-8-18(17)15-22/h1-4,7-10H,5-6,11-16H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	501	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50413512 (CHEMBL490643) Show SMILES [#7]\[#6](-[#7])=[#7]\[#6]-[#6]-[#7]-1-[#6]-2-[#6]-[#6]-[#6]-1-[#6]-[#6](-[#6]-2)-[#8]-[#6]-1-c2ccccc2-[#6]-[#6]-c2ccccc-12 Show InChI InChI=1S/C25H32N4O/c26-25(27)28-13-14-29-19-11-12-20(29)16-21(15-19)30-24-22-7-3-1-5-17(22)9-10-18-6-2-4-8-23(18)24/h1-8,19-21,24H,9-16H2,(H4,26,27,28)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	501	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from Lymnaea stagnalis His-tagged AchBP				J Med Chem 52: 2372-83 (2009) Article DOI: 10.1021/jm801400g BindingDB Entry DOI: 10.7270/Q2NK3DXK
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50413515 (CHEMBL489034) Show SMILES CCCN1CCC(CC1)OC1c2ccccc2CCc2ccccc12 Show InChI InChI=1S/C23H29NO/c1-2-15-24-16-13-20(14-17-24)25-23-21-9-5-3-7-18(21)11-12-19-8-4-6-10-22(19)23/h3-10,20,23H,2,11-17H2,1H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	631	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from Lymnaea stagnalis His-tagged AchBP				J Med Chem 52: 2372-83 (2009) Article DOI: 10.1021/jm801400g BindingDB Entry DOI: 10.7270/Q2NK3DXK
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419178 (CHEMBL1831029) Show SMILES CC1CC[N+]2(C)CCc3c([nH]c4ccccc34)C2C1 Show InChI InChI=1S/C17H23N2/c1-12-7-9-19(2)10-8-14-13-5-3-4-6-15(13)18-17(14)16(19)11-12/h3-6,12,16,18H,7-11H2,1-2H3/q+1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	631	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419192 (CHEMBL1828846) Show SMILES CC1CC2(CCCCC2)NCc2ccccc12 Show InChI InChI=1S/C16H23N/c1-13-11-16(9-5-2-6-10-16)17-12-14-7-3-4-8-15(13)14/h3-4,7-8,13,17H,2,5-6,9-12H2,1H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	631	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419175 (CHEMBL1831034) Show SMILES CN1CC2Cc3ccccc3C1c1ccccc21 |TLB:0:1:12.17:4.5.10,13:12:4.5.10:1.2,9:10:12.17:1.2,THB:16:17:4.5.10:1.2| Show InChI InChI=1S/C17H17N/c1-18-11-13-10-12-6-2-3-8-15(12)17(18)16-9-5-4-7-14(13)16/h2-9,13,17H,10-11H2,1H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	794	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM74511 (1-(1-benzothien-3-ylmethyl)piperidine | 1-(1-benzo...) Show SMILES C(N1CCCCC1)c1csc2ccccc12 Show InChI InChI=1S/C14H17NS/c1-4-8-15(9-5-1)10-12-11-16-14-7-3-2-6-13(12)14/h2-3,6-7,11H,1,4-5,8-10H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50353946 (CHEMBL1831032) Show SMILES C(Cc1cc2ccccc2[nH]1)N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C21H24N2/c1-2-6-17(7-3-1)18-10-13-23(14-11-18)15-12-20-16-19-8-4-5-9-21(19)22-20/h1-9,16,18,22H,10-15H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7 (Homo sapiens (Human))	BDBM82070 (CAS_29790-52-1 | NICOTINE-L (BASE) | Nicotine-D sa...) Show SMILES CN1CCC[C@H]1c1cccnc1 |r| Show InChI InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase KEGG PC cid PC sid PDB UniChem Similars	PDB Article PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from human alpha7 nAChR expressed in human SH-SY5Y cells				J Med Chem 52: 2372-83 (2009) Article DOI: 10.1021/jm801400g BindingDB Entry DOI: 10.7270/Q2NK3DXK
					More data for this Ligand-Target Pair				3D Structure (crystal)
Neuronal acetylcholine receptor subunit alpha-7 (Homo sapiens (Human))	BDBM82070 (CAS_29790-52-1 | NICOTINE-L (BASE) | Nicotine-D sa...) Show SMILES CN1CCC[C@H]1c1cccnc1 |r| Show InChI InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase KEGG PC cid PC sid PDB UniChem Similars	PDB Article PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-MLA from human alpha7 nAChR expressed in human SH-SY5Y cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair				3D Structure (crystal)
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419185 (CHEMBL1831048) Show SMILES C[N+]1(CCO)Cc2sc3ccc(Cl)cc3c2C1 Show InChI InChI=1S/C13H15ClNOS/c1-15(4-5-16)7-11-10-6-9(14)2-3-12(10)17-13(11)8-15/h2-3,6,16H,4-5,7-8H2,1H3/q+1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50413517 (CHEMBL490849) Show SMILES N#CCCN1C2CCC1CC(C2)OC1c2ccccc2CCc2ccccc12 Show InChI InChI=1S/C25H28N2O/c26-14-5-15-27-20-12-13-21(27)17-22(16-20)28-25-23-8-3-1-6-18(23)10-11-19-7-2-4-9-24(19)25/h1-4,6-9,20-22,25H,5,10-13,15-17H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from Lymnaea stagnalis His-tagged AchBP				J Med Chem 52: 2372-83 (2009) Article DOI: 10.1021/jm801400g BindingDB Entry DOI: 10.7270/Q2NK3DXK
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50413518 (CHEMBL490442) Show SMILES ONC(=N)CCN1C2CCC1CC(C2)OC1c2ccccc2CCc2ccccc12 Show InChI InChI=1S/C25H31N3O2/c26-24(27-29)13-14-28-19-11-12-20(28)16-21(15-19)30-25-22-7-3-1-5-17(22)9-10-18-6-2-4-8-23(18)25/h1-8,19-21,25,29H,9-16H2,(H2,26,27)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from Lymnaea stagnalis His-tagged AchBP				J Med Chem 52: 2372-83 (2009) Article DOI: 10.1021/jm801400g BindingDB Entry DOI: 10.7270/Q2NK3DXK
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419177 (CHEMBL1831028) Show SMILES C1CC2N(C1)CCc1c2[nH]c2ccccc12 Show InChI InChI=1S/C14H16N2/c1-2-5-12-10(4-1)11-7-9-16-8-3-6-13(16)14(11)15-12/h1-2,4-5,13,15H,3,6-9H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419189 (CHEMBL1619901) Show SMILES OC(COCc1ccc(Cl)cc1)CN1CCc2ccccc2C1 Show InChI InChI=1S/C19H22ClNO2/c20-18-7-5-15(6-8-18)13-23-14-19(22)12-21-10-9-16-3-1-2-4-17(16)11-21/h1-8,19,22H,9-14H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	1.58E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419200 (CHEMBL1740345) Show SMILES ClC1(CNc2ccccc2)CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C19H23ClN2/c20-19(16-21-18-9-5-2-6-10-18)11-13-22(14-12-19)15-17-7-3-1-4-8-17/h1-10,21H,11-16H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	1.58E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419191 (CHEMBL1828845) Show SMILES CSc1[nH]c2ccccc2c1CN1CCCCC1 Show InChI InChI=1S/C15H20N2S/c1-18-15-13(11-17-9-5-2-6-10-17)12-7-3-4-8-14(12)16-15/h3-4,7-8,16H,2,5-6,9-11H2,1H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.58E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50413510 (HEPZIDINE) Show SMILES CN1CCC(CC1)OC1c2ccccc2CCc2ccccc12 Show InChI InChI=1S/C21H25NO/c1-22-14-12-18(13-15-22)23-21-19-8-4-2-6-16(19)10-11-17-7-3-5-9-20(17)21/h2-9,18,21H,10-15H2,1H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	1.58E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from Lymnaea stagnalis His-tagged AchBP				J Med Chem 52: 2372-83 (2009) Article DOI: 10.1021/jm801400g BindingDB Entry DOI: 10.7270/Q2NK3DXK
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419187 (CHEMBL1624521) Show SMILES CN1CCN(Cc2ccccc2Sc2ccccc2)CC1 Show InChI InChI=1S/C18H22N2S/c1-19-11-13-20(14-12-19)15-16-7-5-6-10-18(16)21-17-8-3-2-4-9-17/h2-10H,11-15H2,1H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.58E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7 (Homo sapiens (Human))	BDBM50267844 (3-(10,11-Dihydro-5H-dibenzo[a,d]cyclohepten-5-ylox...) Show SMILES C[N+]1(C)C2CCC1CC(C2)OC1c2ccccc2CCc2ccccc12 Show InChI InChI=1S/C24H30NO/c1-25(2)19-13-14-20(25)16-21(15-19)26-24-22-9-5-3-7-17(22)11-12-18-8-4-6-10-23(18)24/h3-10,19-21,24H,11-16H2,1-2H3/q+1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from human alpha7 nAChR expressed in human SH-SY5Y cells				J Med Chem 52: 2372-83 (2009) Article DOI: 10.1021/jm801400g BindingDB Entry DOI: 10.7270/Q2NK3DXK
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419197 (CHEMBL1831047) Show SMILES C(CSc1cc2ccccc2[nH]1)CN1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C22H27N3S/c1-2-7-19(8-3-1)18-25-14-12-24(13-15-25)11-6-16-26-22-17-20-9-4-5-10-21(20)23-22/h1-5,7-10,17,23H,6,11-16,18H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50353944 (CHEMBL1831036) Show SMILES C(Cc1nc2ccccc2[nH]1)N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C20H23N3/c1-2-6-16(7-3-1)17-10-13-23(14-11-17)15-12-20-21-18-8-4-5-9-19(18)22-20/h1-9,17H,10-15H2,(H,21,22)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	2.51E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM10759 (2-acetoxyethyl(trimethyl)ammonium;bromide | 2-acet...) Show SMILES CC(=O)OCC[N+](C)(C)C Show InChI InChI=1S/C7H16NO2/c1-7(9)10-6-5-8(2,3)4/h5-6H2,1-4H3/q+1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	PDB Article PubMed	3.16E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from Lymnaea stagnalis His-tagged AchBP				J Med Chem 52: 2372-83 (2009) Article DOI: 10.1021/jm801400g BindingDB Entry DOI: 10.7270/Q2NK3DXK
					More data for this Ligand-Target Pair				3D Structure (crystal)
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50413511 (CHEMBL489015) Show SMILES C1CC(CCN1)OC1c2ccccc2CCc2ccccc12 Show InChI InChI=1S/C20H23NO/c1-3-7-18-15(5-1)9-10-16-6-2-4-8-19(16)20(18)22-17-11-13-21-14-12-17/h1-8,17,20-21H,9-14H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.16E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute Curated by ChEMBL					Assay Description Displacement of [125I]alpha-bungarotoxin from Lymnaea stagnalis His-tagged AchBP				J Med Chem 52: 2372-83 (2009) Article DOI: 10.1021/jm801400g BindingDB Entry DOI: 10.7270/Q2NK3DXK
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419194 (CHEMBL1828849) Show SMILES CC(Cc1ccccc1)NC1CN2CCC1CC2 |THB:9:10:13.14:17.16,(49.97,-42.94,;49.74,-44.46,;50.94,-45.42,;52.38,-44.86,;53.58,-45.82,;55.01,-45.26,;55.24,-43.73,;54.03,-42.77,;52.6,-43.34,;48.31,-45.02,;47.1,-44.06,;47.4,-42.55,;45.92,-43.23,;44.25,-42.53,;44.04,-44.03,;45.64,-44.72,;45.71,-46.5,;46.19,-45.3,)| Show InChI InChI=1S/C16H24N2/c1-13(11-14-5-3-2-4-6-14)17-16-12-18-9-7-15(16)8-10-18/h2-6,13,15-17H,7-12H2,1H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	3.16E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419195 (CHEMBL1828847) Show SMILES CCN(CC)Cc1csc2ccc(Cl)cc12 Show InChI InChI=1S/C13H16ClNS/c1-3-15(4-2)8-10-9-16-13-6-5-11(14)7-12(10)13/h5-7,9H,3-4,8H2,1-2H3	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.98E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-7 (Homo sapiens (Human))	BDBM50419191 (CHEMBL1828845) Show SMILES CSc1[nH]c2ccccc2c1CN1CCCCC1 Show InChI InChI=1S/C15H20N2S/c1-18-15-13(11-17-9-5-2-6-10-17)12-7-3-4-8-14(12)16-15/h3-4,7-8,16H,2,5-6,9-11H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	3.98E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-MLA from human alpha7 nAChR expressed in human SH-SY5Y cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419181 (CHEMBL1831042) Show SMILES NCC(OCc1ccc(Cl)cc1Cl)c1ccccc1 Show InChI InChI=1S/C15H15Cl2NO/c16-13-7-6-12(14(17)8-13)10-19-15(9-18)11-4-2-1-3-5-11/h1-8,15H,9-10,18H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.01E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM50419182 (CHEMBL1831044) Show SMILES NCC(OCc1ccc(Cl)cc1)c1ccccc1 Show InChI InChI=1S/C15H16ClNO/c16-14-8-6-12(7-9-14)11-18-15(10-17)13-4-2-1-3-5-13/h1-9,15H,10-11,17H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	6.31E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM10759 (2-acetoxyethyl(trimethyl)ammonium;bromide | 2-acet...) Show SMILES CC(=O)OCC[N+](C)(C)C Show InChI InChI=1S/C7H16NO2/c1-7(9)10-6-5-8(2,3)4/h5-6H2,1-4H3/q+1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	PDB Article PubMed	6.31E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-epibatidine from histidine-tagged Lymnaea stagnalis AChBP expressed in Sf9 cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair				3D Structure (crystal)
Neuronal acetylcholine receptor subunit alpha-7 (Homo sapiens (Human))	BDBM10759 (2-acetoxyethyl(trimethyl)ammonium;bromide | 2-acet...) Show SMILES CC(=O)OCC[N+](C)(C)C Show InChI InChI=1S/C7H16NO2/c1-7(9)10-6-5-8(2,3)4/h5-6H2,1-4H3/q+1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	7.94E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-MLA from human alpha7 nAChR expressed in human SH-SY5Y cells after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem 19: 6107-19 (2011) Article DOI: 10.1016/j.bmc.2011.08.028 BindingDB Entry DOI: 10.7270/Q2SN09BH
					More data for this Ligand-Target Pair

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