Compile Data Set for Download or QSAR

Found 42 hits Enz. Inhib. hit(s) with Target = 'Neuronal acetylcholine receptor subunit beta-2/beta-4'   

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 beta-2/beta-4 (Mus musculus)	BDBM50270397 (CHEMBL4070098) Show SMILES [I-].[H][C@]12CCC[N+]1(C)CCc1cc3OCOc3cc21 |r| Show InChI InChI=1S/C14H18NO2.HI/c1-15-5-2-3-12(15)11-8-14-13(16-9-17-14)7-10(11)4-6-15;/h7-8,12H,2-6,9H2,1H3;1H/q+1;/p-1/t12-,15?;/m1./s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270370 (CHEMBL4101688) Show SMILES [I-].C[N+]12CCCC1c1cc3OCOc3cc1CC2 Show InChI InChI=1S/C14H18NO2.HI/c1-15-5-2-3-12(15)11-8-14-13(16-9-17-14)7-10(11)4-6-15;/h7-8,12H,2-6,9H2,1H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	520	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270396 (CHEMBL4073773) Show SMILES COC1CC=C2CCN3CCC4=C(CC(=O)OC4)[C@]23C1 |r,t:4,11| Show InChI InChI=1S/C16H21NO3/c1-19-13-3-2-12-5-7-17-6-4-11-10-20-15(18)8-14(11)16(12,17)9-13/h2,13H,3-10H2,1H3/t13?,16-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270401 (CHEMBL4064521) Show SMILES [I-].COc1cc2CC[N+](C)(C)Cc2cc1O Show InChI InChI=1S/C12H17NO2/c1-13(2)5-4-9-7-12(15-3)11(14)6-10(9)8-13/h6-7H,4-5,8H2,1-3H3/p+1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270364 (CHEMBL4064684) Show SMILES [H][C@]12CCCN1CCc1cc3OCOc3cc21 |r| Show InChI InChI=1S/C13H15NO2/c1-2-11-10-7-13-12(15-8-16-13)6-9(10)3-5-14(11)4-1/h6-7,11H,1-5,8H2/t11-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270402 (CHEMBL4097677) Show SMILES [I-].COc1ccc2C[N+](C)(C)CCc2c1 Show InChI InChI=1S/C12H18NO/c1-13(2)7-6-10-8-12(14-3)5-4-11(10)9-13/h4-5,8H,6-7,9H2,1-3H3/q+1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270368 (CHEMBL4082570) Show SMILES [I-].COc1ccc2CC[N+]3(C)CCCC3c2c1 Show InChI InChI=1S/C14H20NO.HI/c1-15-8-3-4-14(15)13-10-12(16-2)6-5-11(13)7-9-15;/h5-6,10,14H,3-4,7-9H2,1-2H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50006634 (CHEMBL3235510) Show SMILES C1CC2N(C1)CCc1cc3OCOc3cc21 Show InChI InChI=1S/C13H15NO2/c1-2-11-10-7-13-12(15-8-16-13)6-9(10)3-5-14(11)4-1/h6-7,11H,1-5,8H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50006638 (CHEMBL2140445) Show SMILES CN1CCc2cc3OCOc3cc2C1 Show InChI InChI=1S/C11H13NO2/c1-12-3-2-8-4-10-11(14-7-13-10)5-9(8)6-12/h4-5H,2-3,6-7H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270372 (CHEMBL4104998) Show SMILES [I-].COc1cc2C3CCC[N+]3(C)CCc2cc1Oc1ccccc1 Show InChI InChI=1S/C20H24NO2.HI/c1-21-11-6-9-18(21)17-14-19(22-2)20(13-15(17)10-12-21)23-16-7-4-3-5-8-16;/h3-5,7-8,13-14,18H,6,9-12H2,1-2H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50006640 (CHEMBL593001) Show SMILES COc1cc2CCN(C)Cc2cc1O Show InChI InChI=1S/C11H15NO2/c1-12-4-3-8-6-11(14-2)10(13)5-9(8)7-12/h5-6,13H,3-4,7H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270371 (CHEMBL4087153) Show SMILES [I-].COc1cc2CC[N+]3(C)CCCC3c2cc1Oc1ccccc1 Show InChI InChI=1S/C20H24NO2.HI/c1-21-11-6-9-18(21)17-14-20(23-16-7-4-3-5-8-16)19(22-2)13-15(17)10-12-21;/h3-5,7-8,13-14,18H,6,9-12H2,1-2H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270375 (CHEMBL4075463) Show SMILES COc1ccc2CN(C)CCc2c1 Show InChI InChI=1S/C11H15NO/c1-12-6-5-9-7-11(13-2)4-3-10(9)8-12/h3-4,7H,5-6,8H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270382 (CHEMBL4082090) Show SMILES [I-].[H][C@]12CCC[N+]1(C)CCc1cc(OC)c(OC)cc21 |r| Show InChI InChI=1S/C15H22NO2.HI/c1-16-7-4-5-13(16)12-10-15(18-3)14(17-2)9-11(12)6-8-16;/h9-10,13H,4-8H2,1-3H3;1H/q+1;/p-1/t13-,16?;/m1./s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270388 (CHEMBL4083525) Show SMILES [I-].COc1cc2C[N+](C)(C)CCc2cc1OCc1ccccc1 Show InChI InChI=1S/C19H24NO2/c1-20(2)10-9-16-11-19(18(21-3)12-17(16)13-20)22-14-15-7-5-4-6-8-15/h4-8,11-12H,9-10,13-14H2,1-3H3/q+1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270405 (CHEMBL4102579) Show SMILES COc1ccc2CCN3CCCC3c2c1 Show InChI InChI=1S/C13H17NO/c1-15-11-5-4-10-6-8-14-7-2-3-13(14)12(10)9-11/h4-5,9,13H,2-3,6-8H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270407 (CHEMBL1570477) Show SMILES [I-].COc1cc2CC[N+](C)(C)Cc2cc1OC Show InChI InChI=1S/C13H20NO2/c1-14(2)6-5-10-7-12(15-3)13(16-4)8-11(10)9-14/h7-8H,5-6,9H2,1-4H3/q+1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270395 (CHEMBL4092845) Show SMILES [I-].CC[N+]1(C)CCc2cc(OC)c(OC)cc2C1 Show InChI InChI=1S/C14H22NO2.HI/c1-5-15(2)7-6-11-8-13(16-3)14(17-4)9-12(11)10-15;/h8-9H,5-7,10H2,1-4H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50014648 (6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydro-isoquino...) Show SMILES COc1cc2CCN(C)Cc2cc1OC Show InChI InChI=1S/C12H17NO2/c1-13-5-4-9-6-11(14-2)12(15-3)7-10(9)8-13/h6-7H,4-5,8H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270399 (CHEMBL4073109) Show SMILES [I-].C[N+]1(C)CCc2cc3OCOc3cc2C1 Show InChI InChI=1S/C12H16NO2/c1-13(2)4-3-9-5-11-12(15-8-14-11)6-10(9)7-13/h5-6H,3-4,7-8H2,1-2H3/q+1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270373 (CHEMBL4073899) Show SMILES C1CC2N(C1)CCc1ccccc21 Show InChI InChI=1S/C12H15N/c1-2-5-11-10(4-1)7-9-13-8-3-6-12(11)13/h1-2,4-5,12H,3,6-9H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270362 (CHEMBL4077320) Show SMILES [H][C@]12CCCN1CCc1cc(OC)c(OC)cc21 |r| Show InChI InChI=1S/C14H19NO2/c1-16-13-8-10-5-7-15-6-3-4-12(15)11(10)9-14(13)17-2/h8-9,12H,3-7H2,1-2H3/t12-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase 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
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270389 (CHEMBL4061335) Show SMILES COc1cc2CCN(C)Cc2cc1OCc1ccccc1 Show InChI InChI=1S/C18H21NO2/c1-19-9-8-15-10-17(20-2)18(11-16(15)12-19)21-13-14-6-4-3-5-7-14/h3-7,10-11H,8-9,12-13H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270390 (CHEMBL4062419) Show SMILES COc1cc2CN(C)CCc2cc1OCc1ccccc1 Show InChI InChI=1S/C18H21NO2/c1-19-9-8-15-10-18(17(20-2)11-16(15)12-19)21-13-14-6-4-3-5-7-14/h3-7,10-11H,8-9,12-13H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270393 (CHEMBL4071054) Show SMILES [Br-].COc1cc2CC[N+](C)(CC=C)Cc2cc1OC Show InChI InChI=1S/C15H22NO2.BrH/c1-5-7-16(2)8-6-12-9-14(17-3)15(18-4)10-13(12)11-16;/h5,9-10H,1,6-8,11H2,2-4H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270365 (CHEMBL4078302) Show SMILES [H][C@@]12CCCN1CCc1cc3OCOc3cc21 |r| Show InChI InChI=1S/C13H15NO2/c1-2-11-10-7-13-12(15-8-16-13)6-9(10)3-5-14(11)4-1/h6-7,11H,1-5,8H2/t11-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270369 (CHEMBL4083684) Show SMILES [I-].COc1cc2CC[N+]3(C)CCCC3c2cc1OC Show InChI InChI=1S/C15H22NO2.HI/c1-16-7-4-5-13(16)12-10-15(18-3)14(17-2)9-11(12)6-8-16;/h9-10,13H,4-8H2,1-3H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270406 (CHEMBL4084130) Show SMILES [Br-].COc1cc2CC[N+](C)(Cc3ccccc3)Cc2cc1OC Show InChI InChI=1S/C19H24NO2.BrH/c1-20(13-15-7-5-4-6-8-15)10-9-16-11-18(21-2)19(22-3)12-17(16)14-20;/h4-8,11-12H,9-10,13-14H2,1-3H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270394 (CHEMBL4061094) Show SMILES [I-].CCC[N+]1(C)CCc2cc(OC)c(OC)cc2C1 Show InChI InChI=1S/C15H24NO2.HI/c1-5-7-16(2)8-6-12-9-14(17-3)15(18-4)10-13(12)11-16;/h9-10H,5-8,11H2,1-4H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270374 (CHEMBL4099972) Show SMILES [I-].COc1cc2CC[N+](C)(C)Cc2cc1OCc1ccccc1 Show InChI InChI=1S/C19H24NO2/c1-20(2)10-9-16-11-18(21-3)19(12-17(16)13-20)22-14-15-7-5-4-6-8-15/h4-8,11-12H,9-10,13-14H2,1-3H3/q+1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50006633 (CHEMBL3235509) Show SMILES COc1cc2CCN3CCCC3c2cc1OC Show InChI InChI=1S/C14H19NO2/c1-16-13-8-10-5-7-15-6-3-4-12(15)11(10)9-14(13)17-2/h8-9,12H,3-7H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270367 (CHEMBL4067385) Show SMILES [I-].COc1ccc2C3CCC[N+]3(C)CCc2c1 Show InChI InChI=1S/C14H20NO.HI/c1-15-8-3-4-14(15)13-6-5-12(16-2)10-11(13)7-9-15;/h5-6,10,14H,3-4,7-9H2,1-2H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270403 (CHEMBL4080088) Show SMILES COc1cc2C3CCCN3CCc2cc1Oc1ccccc1 Show InChI InChI=1S/C19H21NO2/c1-21-18-13-16-14(9-11-20-10-5-8-17(16)20)12-19(18)22-15-6-3-2-4-7-15/h2-4,6-7,12-13,17H,5,8-11H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50006628 (CHEMBL3235504) Show SMILES [H][C@]12CCN3CCc4cc(OC)c(OC)cc4[C@]13CCCC2 |r| Show InChI InChI=1S/C18H25NO2/c1-20-16-11-13-6-9-19-10-7-14-5-3-4-8-18(14,19)15(13)12-17(16)21-2/h11-12,14H,3-10H2,1-2H3/t14-,18-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4/beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced activity by FLIPR membrane p...				J Med Chem 56: 9673-82 (2014) Article DOI: 10.1021/jm4013592 BindingDB Entry DOI: 10.7270/Q2JS9RZK
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270398 (CHEMBL4067398) Show SMILES COc1cc2CCN3CCCC3c2cc1Oc1ccccc1 Show InChI InChI=1S/C19H21NO2/c1-21-18-12-14-9-11-20-10-5-8-17(20)16(14)13-19(18)22-15-6-3-2-4-7-15/h2-4,6-7,12-13,17H,5,8-11H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	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
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270366 (CHEMBL4087050) Show SMILES [I-].C[N+]12CCCC1c1ccccc1CC2 Show InChI InChI=1S/C13H18N.HI/c1-14-9-4-7-13(14)12-6-3-2-5-11(12)8-10-14;/h2-3,5-6,13H,4,7-10H2,1H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	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
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270361 (CHEMBL4077524) Show SMILES [I-].[H][C@@]12CCC[N+]1(C)CCc1cc3OCOc3cc21 |r| Show InChI InChI=1S/C14H18NO2.HI/c1-15-5-2-3-12(15)11-8-14-13(16-9-17-14)7-10(11)4-6-15;/h7-8,12H,2-6,9H2,1H3;1H/q+1;/p-1/t12-,15?;/m0./s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270376 (Laudanosine) Show SMILES COc1ccc(CC2N(C)CCc3cc(OC)c(OC)cc23)cc1OC Show InChI InChI=1S/C21H27NO4/c1-22-9-8-15-12-20(25-4)21(26-5)13-16(15)17(22)10-14-6-7-18(23-2)19(11-14)24-3/h6-7,11-13,17H,8-10H2,1-5H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270363 (CHEMBL4086188) Show SMILES [H][C@@]12CCCN1CCc1cc(OC)c(OC)cc21 |r| Show InChI InChI=1S/C14H19NO2/c1-16-13-8-10-5-7-15-6-3-4-12(15)11(10)9-14(13)17-2/h8-9,12H,3-7H2,1-2H3/t12-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270400 (CHEMBL363360) Show SMILES [I-].COc1ccc(CC2c3cc(OC)c(OC)cc3CC[N+]2(C)C)cc1OC Show InChI InChI=1S/C22H30NO4.HI/c1-23(2)10-9-16-13-21(26-5)22(27-6)14-17(16)18(23)11-15-7-8-19(24-3)20(12-15)25-4;/h7-8,12-14,18H,9-11H2,1-6H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270377 (CHEMBL4081330) Show SMILES [I-].[H][C@@]12CCC[N+]1(C)CCc1cc(OC)c(OC)cc21 |r| Show InChI InChI=1S/C15H22NO2.HI/c1-16-7-4-5-13(16)12-10-15(18-3)14(17-2)9-11(12)6-8-16;/h9-10,13H,4-8H2,1-3H3;1H/q+1;/p-1/t13-,16?;/m0./s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit beta-2/beta-4 (Mus musculus)	BDBM50270404 (CHEMBL4097292) Show SMILES COc1ccc2C3CCCN3CCc2c1 Show InChI InChI=1S/C13H17NO/c1-15-11-4-5-12-10(9-11)6-8-14-7-2-3-13(12)14/h4-5,9,13H,2-3,6-8H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at mouse alpha4beta2 nAChR expressed in HEK293 cells assessed as inhibition of (S)-nicotine-induced current response measured up ...				J Med Chem 61: 1719-1729 (2018) Article DOI: 10.1021/acs.jmedchem.7b01895 BindingDB Entry DOI: 10.7270/Q2668GPB
					More data for this Ligand-Target Pair