Compile Data Set for Download or QSAR

Found 33 hits with Last Name = 'yoo' and Initial = 'dt'   

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
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50352148 (CHEMBL1824789) Show SMILES Fc1cccc(CCN2C3CC4CC(C3)CC2C4)c1 |TLB:17:16:14:10.11.12,THB:17:11:8.16.15:14,12:11:8:15.13.14,12:13:8:10.17.11,7:8:14:10.11.12| Show InChI InChI=1S/C17H22FN/c18-15-3-1-2-12(7-15)4-5-19-16-8-13-6-14(10-16)11-17(19)9-13/h1-3,7,13-14,16-17H,4-6,8-11H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Displacement of [3H](+)-pentazocine from sigma 1 receptor in guinea pig brain homogenates after 90 mins by scintillation counting				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50352149 (CHEMBL1824788) Show SMILES COc1ccc(CN2C3CC4CC(C3)CC2C4)cc1 |TLB:16:15:13:9.10.11,THB:16:10:7.15.14:13,11:10:7:14.12.13,11:12:7:9.16.10,6:7:13:9.10.11| Show InChI InChI=1S/C17H23NO/c1-19-17-4-2-12(3-5-17)11-18-15-7-13-6-14(9-15)10-16(18)8-13/h2-5,13-16H,6-11H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Displacement of [3H](+)-pentazocine from sigma 1 receptor in guinea pig brain homogenates after 90 mins by scintillation counting				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50352151 (CHEMBL1824786) Show SMILES Fc1ccc(CN2C3CC4CC(C3)CC2C4)cc1 |TLB:15:14:12:8.9.10,THB:15:9:6.14.13:12,10:9:6:13.11.12,10:11:6:8.15.9,5:6:12:8.9.10| Show InChI InChI=1S/C16H20FN/c17-14-3-1-11(2-4-14)10-18-15-6-12-5-13(8-15)9-16(18)7-12/h1-4,12-13,15-16H,5-10H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Displacement of [3H](+)-pentazocine from sigma 1 receptor in guinea pig brain homogenates after 90 mins by scintillation counting				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50352147 (CHEMBL1824790) Show SMILES Fc1ccc(CCN2C3CC4CC(C3)CC2C4)cc1 |TLB:16:15:13:9.10.11,THB:16:10:7.15.14:13,11:10:7:14.12.13,11:12:7:9.16.10,6:7:13:9.10.11| Show InChI InChI=1S/C17H22FN/c18-15-3-1-12(2-4-15)5-6-19-16-8-13-7-14(10-16)11-17(19)9-13/h1-4,13-14,16-17H,5-11H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Displacement of [3H](+)-pentazocine from sigma 1 receptor in guinea pig brain homogenates after 90 mins by scintillation counting				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50352152 (CHEMBL1824785) Show SMILES Fc1cccc(CN2C3CC4CC(C3)CC2C4)c1 |TLB:16:15:13:9.10.11,THB:16:10:7.15.14:13,11:10:7:14.12.13,11:12:7:9.16.10,6:7:13:9.10.11| Show InChI InChI=1S/C16H20FN/c17-14-3-1-2-11(5-14)10-18-15-6-12-4-13(8-15)9-16(18)7-12/h1-3,5,12-13,15-16H,4,6-10H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Displacement of [3H](+)-pentazocine from sigma 1 receptor in guinea pig brain homogenates after 90 mins by scintillation counting				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50352153 (CHEMBL1824784) Show SMILES C(N1C2CC3CC(C2)CC1C3)c1ccccc1 |TLB:10:9:7:3.4.5,THB:10:4:1.9.8:7,5:4:1:8.6.7,5:6:1:3.10.4,0:1:7:3.4.5| Show InChI InChI=1S/C16H21N/c1-2-4-12(5-3-1)11-17-15-7-13-6-14(9-15)10-16(17)8-13/h1-5,13-16H,6-11H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	29	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Displacement of [3H](+)-pentazocine from sigma 1 receptor in guinea pig brain homogenates after 90 mins by scintillation counting				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50352155 (CHEMBL1824782) Show SMILES OC12CC3CC(CC(C3)N1CCc1cccc(F)c1)C2 |TLB:8:7:19:2.3.4,8:3:9.7.6:19,4:5:9:2.8.3,THB:4:3:9:6.5.19,10:9:19:2.3.4| Show InChI InChI=1S/C17H22FNO/c18-15-3-1-2-12(7-15)4-5-19-16-8-13-6-14(9-16)11-17(19,20)10-13/h1-3,7,13-14,16,20H,4-6,8-11H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	234	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Displacement of [3H](+)-pentazocine from sigma 1 receptor in guinea pig brain homogenates after 90 mins by scintillation counting				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50352150 (CHEMBL1824787) Show SMILES COc1cccc(CN2C3CC4CC(C3)CC2C4)c1 |TLB:17:16:14:10.11.12,THB:17:11:8.16.15:14,12:11:8:15.13.14,12:13:8:10.17.11,7:8:14:10.11.12| Show InChI InChI=1S/C17H23NO/c1-19-17-4-2-3-12(10-17)11-18-15-6-13-5-14(8-15)9-16(18)7-13/h2-4,10,13-16H,5-9,11H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	239	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Displacement of [3H](+)-pentazocine from sigma 1 receptor in guinea pig brain homogenates after 90 mins by scintillation counting				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50352154 (CHEMBL1824783) Show SMILES OC12CC3CC(CC(C3)N1CCc1ccc(F)cc1)C2 |TLB:8:7:19:2.3.4,8:3:9.7.6:19,4:5:9:2.8.3,THB:4:3:9:6.5.19,10:9:19:2.3.4| Show InChI InChI=1S/C17H22FNO/c18-15-3-1-12(2-4-15)5-6-19-16-8-13-7-14(9-16)11-17(19,20)10-13/h1-4,13-14,16,20H,5-11H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	246	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Displacement of [3H](+)-pentazocine from sigma 1 receptor in guinea pig brain homogenates after 90 mins by scintillation counting				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50352158 (CHEMBL1824779) Show SMILES OC12CC3CC(CC(C3)N1Cc1ccc(F)cc1)C2 |TLB:8:7:18:2.3.4,8:3:9.7.6:18,4:5:9:2.8.3,THB:4:3:9:6.5.18,10:9:18:2.3.4| Show InChI InChI=1S/C16H20FNO/c17-14-3-1-11(2-4-14)10-18-15-6-12-5-13(7-15)9-16(18,19)8-12/h1-4,12-13,15,19H,5-10H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	650	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Displacement of [3H](+)-pentazocine from sigma 1 receptor in guinea pig brain homogenates after 90 mins by scintillation counting				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50352160 (CHEMBL1824777) Show SMILES OC12CC3CC(CC(C3)N1Cc1ccccc1)C2 |TLB:8:7:17:2.3.4,8:3:9.7.6:17,4:5:9:2.8.3,THB:4:3:9:6.5.17,10:9:17:2.3.4| Show InChI InChI=1S/C16H21NO/c18-16-9-13-6-14(10-16)8-15(7-13)17(16)11-12-4-2-1-3-5-12/h1-5,13-15,18H,6-11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	662	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of kappa opioid receptor by NIMH PDSP				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50352159 (CHEMBL1824778) Show SMILES OC12CC3CC(CC(C3)N1Cc1cccc(F)c1)C2 |TLB:8:7:18:2.3.4,8:3:9.7.6:18,4:5:9:2.8.3,THB:4:3:9:6.5.18,10:9:18:2.3.4| Show InChI InChI=1S/C16H20FNO/c17-14-3-1-2-11(5-14)10-18-15-6-12-4-13(7-15)9-16(18,19)8-12/h1-3,5,12-13,15,19H,4,6-10H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	862	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Displacement of [3H](+)-pentazocine from sigma 1 receptor in guinea pig brain homogenates after 90 mins by scintillation counting				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50352159 (CHEMBL1824778) Show SMILES OC12CC3CC(CC(C3)N1Cc1cccc(F)c1)C2 |TLB:8:7:18:2.3.4,8:3:9.7.6:18,4:5:9:2.8.3,THB:4:3:9:6.5.18,10:9:18:2.3.4| Show InChI InChI=1S/C16H20FNO/c17-14-3-1-2-11(5-14)10-18-15-6-12-4-13(7-15)9-16(18,19)8-12/h1-3,5,12-13,15,19H,4,6-10H2	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of kappa opioid receptor by NIMH PDSP				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50352156 (CHEMBL1824781) Show SMILES COc1ccc(CN2C3CC4CC(C3)CC2(O)C4)cc1 |TLB:9:10:7.8.13:14,6:7:14:17.10.11,THB:9:8:14:17.10.11,11:10:7:13.12.14,11:12:7:17.9.10| Show InChI InChI=1S/C17H23NO2/c1-20-16-4-2-12(3-5-16)11-18-15-7-13-6-14(8-15)10-17(18,19)9-13/h2-5,13-15,19H,6-11H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.24E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Displacement of [3H](+)-pentazocine from sigma 1 receptor in guinea pig brain homogenates after 90 mins by scintillation counting				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M4 (Homo sapiens (Human))	BDBM50352152 (CHEMBL1824785) Show SMILES Fc1cccc(CN2C3CC4CC(C3)CC2C4)c1 |TLB:16:15:13:9.10.11,THB:16:10:7.15.14:13,11:10:7:14.12.13,11:12:7:9.16.10,6:7:13:9.10.11| Show InChI InChI=1S/C16H20FN/c17-14-3-1-2-11(5-14)10-18-15-6-12-4-13(8-15)9-16(18)7-12/h1-3,5,12-13,15-16H,4,6-10H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.36E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of M4 muscarinic receptor by NIMH PDSP				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50352160 (CHEMBL1824777) Show SMILES OC12CC3CC(CC(C3)N1Cc1ccccc1)C2 |TLB:8:7:17:2.3.4,8:3:9.7.6:17,4:5:9:2.8.3,THB:4:3:9:6.5.17,10:9:17:2.3.4| Show InChI InChI=1S/C16H21NO/c18-16-9-13-6-14(10-16)8-15(7-13)17(16)11-12-4-2-1-3-5-12/h1-5,13-15,18H,6-11H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.45E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Displacement of [3H](+)-pentazocine from sigma 1 receptor in guinea pig brain homogenates after 90 mins by scintillation counting				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M4 (Homo sapiens (Human))	BDBM50352153 (CHEMBL1824784) Show SMILES C(N1C2CC3CC(C2)CC1C3)c1ccccc1 |TLB:10:9:7:3.4.5,THB:10:4:1.9.8:7,5:4:1:8.6.7,5:6:1:3.10.4,0:1:7:3.4.5| Show InChI InChI=1S/C16H21N/c1-2-4-12(5-3-1)11-17-15-7-13-6-14(9-15)10-16(17)8-13/h1-5,13-16H,6-11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.78E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of M4 muscarinic receptor by NIMH PDSP				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Cavia porcellus (Guinea pig))	BDBM50352157 (CHEMBL1824780) Show SMILES COc1cccc(CN2C3CC4CC(C3)CC2(O)C4)c1 |TLB:10:11:8.9.14:15,7:8:15:18.11.12,THB:10:9:15:18.11.12,12:11:8:14.13.15,12:13:8:18.10.11| Show InChI InChI=1S/C17H23NO2/c1-20-16-4-2-3-12(8-16)11-18-15-6-13-5-14(7-15)10-17(18,19)9-13/h2-4,8,13-15,19H,5-7,9-11H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.95E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Displacement of [3H](+)-pentazocine from sigma 1 receptor in guinea pig brain homogenates after 90 mins by scintillation counting				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50352152 (CHEMBL1824785) Show SMILES Fc1cccc(CN2C3CC4CC(C3)CC2C4)c1 |TLB:16:15:13:9.10.11,THB:16:10:7.15.14:13,11:10:7:14.12.13,11:12:7:9.16.10,6:7:13:9.10.11| Show InChI InChI=1S/C16H20FN/c17-14-3-1-2-11(5-14)10-18-15-6-12-4-13(8-15)9-16(18)7-12/h1-3,5,12-13,15-16H,4,6-10H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.54E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of M2 muscarinic receptor by NIMH PDSP				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50352153 (CHEMBL1824784) Show SMILES C(N1C2CC3CC(C2)CC1C3)c1ccccc1 |TLB:10:9:7:3.4.5,THB:10:4:1.9.8:7,5:4:1:8.6.7,5:6:1:3.10.4,0:1:7:3.4.5| Show InChI InChI=1S/C16H21N/c1-2-4-12(5-3-1)11-17-15-7-13-6-14(9-15)10-16(17)8-13/h1-5,13-16H,6-11H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of M2 muscarinic receptor by NIMH PDSP				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M5 (Homo sapiens (Human))	BDBM50352152 (CHEMBL1824785) Show SMILES Fc1cccc(CN2C3CC4CC(C3)CC2C4)c1 |TLB:16:15:13:9.10.11,THB:16:10:7.15.14:13,11:10:7:14.12.13,11:12:7:9.16.10,6:7:13:9.10.11| Show InChI InChI=1S/C16H20FN/c17-14-3-1-2-11(5-14)10-18-15-6-12-4-13(8-15)9-16(18)7-12/h1-3,5,12-13,15-16H,4,6-10H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.48E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of M5 muscarinic receptor by NIMH PDSP				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M5 (Homo sapiens (Human))	BDBM50352153 (CHEMBL1824784) Show SMILES C(N1C2CC3CC(C2)CC1C3)c1ccccc1 |TLB:10:9:7:3.4.5,THB:10:4:1.9.8:7,5:4:1:8.6.7,5:6:1:3.10.4,0:1:7:3.4.5| Show InChI InChI=1S/C16H21N/c1-2-4-12(5-3-1)11-17-15-7-13-6-14(9-15)10-16(17)8-13/h1-5,13-16H,6-11H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.55E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of M5 muscarinic receptor by NIMH PDSP				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50352152 (CHEMBL1824785) Show SMILES Fc1cccc(CN2C3CC4CC(C3)CC2C4)c1 |TLB:16:15:13:9.10.11,THB:16:10:7.15.14:13,11:10:7:14.12.13,11:12:7:9.16.10,6:7:13:9.10.11| Show InChI InChI=1S/C16H20FN/c17-14-3-1-2-11(5-14)10-18-15-6-12-4-13(8-15)9-16(18)7-12/h1-3,5,12-13,15-16H,4,6-10H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of NET transporter by NIMH PDSP				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50352153 (CHEMBL1824784) Show SMILES C(N1C2CC3CC(C2)CC1C3)c1ccccc1 |TLB:10:9:7:3.4.5,THB:10:4:1.9.8:7,5:4:1:8.6.7,5:6:1:3.10.4,0:1:7:3.4.5| Show InChI InChI=1S/C16H21N/c1-2-4-12(5-3-1)11-17-15-7-13-6-14(9-15)10-16(17)8-13/h1-5,13-16H,6-11H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of NET transporter by NIMH PDSP				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50352159 (CHEMBL1824778) Show SMILES OC12CC3CC(CC(C3)N1Cc1cccc(F)c1)C2 |TLB:8:7:18:2.3.4,8:3:9.7.6:18,4:5:9:2.8.3,THB:4:3:9:6.5.18,10:9:18:2.3.4| Show InChI InChI=1S/C16H20FNO/c17-14-3-1-2-11(5-14)10-18-15-6-12-4-13(7-15)9-16(18,19)8-12/h1-3,5,12-13,15,19H,4,6-10H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of NET transporter by NIMH PDSP				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (Homo sapiens (Human))	BDBM50352152 (CHEMBL1824785) Show SMILES Fc1cccc(CN2C3CC4CC(C3)CC2C4)c1 |TLB:16:15:13:9.10.11,THB:16:10:7.15.14:13,11:10:7:14.12.13,11:12:7:9.16.10,6:7:13:9.10.11| Show InChI InChI=1S/C16H20FN/c17-14-3-1-2-11(5-14)10-18-15-6-12-4-13(8-15)9-16(18)7-12/h1-3,5,12-13,15-16H,4,6-10H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of D1 dopamine receptor by NIMH PDSP				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Alpha-2A adrenergic receptor (Homo sapiens (Human))	BDBM50352160 (CHEMBL1824777) Show SMILES OC12CC3CC(CC(C3)N1Cc1ccccc1)C2 |TLB:8:7:17:2.3.4,8:3:9.7.6:17,4:5:9:2.8.3,THB:4:3:9:6.5.17,10:9:17:2.3.4| Show InChI InChI=1S/C16H21NO/c18-16-9-13-6-14(10-16)8-15(7-13)17(16)11-12-4-2-1-3-5-12/h1-5,13-15,18H,6-11H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of alpha-2A adrenergic receptor by NIMH PDSP				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Alpha-1A adrenergic receptor (Homo sapiens (Human))	BDBM50352152 (CHEMBL1824785) Show SMILES Fc1cccc(CN2C3CC4CC(C3)CC2C4)c1 |TLB:16:15:13:9.10.11,THB:16:10:7.15.14:13,11:10:7:14.12.13,11:12:7:9.16.10,6:7:13:9.10.11| Show InChI InChI=1S/C16H20FN/c17-14-3-1-2-11(5-14)10-18-15-6-12-4-13(8-15)9-16(18)7-12/h1-3,5,12-13,15-16H,4,6-10H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of alpha-1A adrenergic receptor by NIMH PDSP				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Histamine H1 receptor (Homo sapiens (Human))	BDBM50352159 (CHEMBL1824778) Show SMILES OC12CC3CC(CC(C3)N1Cc1cccc(F)c1)C2 |TLB:8:7:18:2.3.4,8:3:9.7.6:18,4:5:9:2.8.3,THB:4:3:9:6.5.18,10:9:18:2.3.4| Show InChI InChI=1S/C16H20FNO/c17-14-3-1-2-11(5-14)10-18-15-6-12-4-13(7-15)9-16(18,19)8-12/h1-3,5,12-13,15,19H,4,6-10H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	<1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of H1 receptor by NIMH PDSP				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Histamine H1 receptor (Homo sapiens (Human))	BDBM50352153 (CHEMBL1824784) Show SMILES C(N1C2CC3CC(C2)CC1C3)c1ccccc1 |TLB:10:9:7:3.4.5,THB:10:4:1.9.8:7,5:4:1:8.6.7,5:6:1:3.10.4,0:1:7:3.4.5| Show InChI InChI=1S/C16H21N/c1-2-4-12(5-3-1)11-17-15-7-13-6-14(9-15)10-16(17)8-13/h1-5,13-16H,6-11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	<1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of H1 receptor by NIMH PDSP				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Histamine H1 receptor (Homo sapiens (Human))	BDBM50352160 (CHEMBL1824777) Show SMILES OC12CC3CC(CC(C3)N1Cc1ccccc1)C2 |TLB:8:7:17:2.3.4,8:3:9.7.6:17,4:5:9:2.8.3,THB:4:3:9:6.5.17,10:9:17:2.3.4| Show InChI InChI=1S/C16H21NO/c18-16-9-13-6-14(10-16)8-15(7-13)17(16)11-12-4-2-1-3-5-12/h1-5,13-15,18H,6-11H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	<1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of H1 receptor by NIMH PDSP				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Histamine H1 receptor (Homo sapiens (Human))	BDBM50352152 (CHEMBL1824785) Show SMILES Fc1cccc(CN2C3CC4CC(C3)CC2C4)c1 |TLB:16:15:13:9.10.11,THB:16:10:7.15.14:13,11:10:7:14.12.13,11:12:7:9.16.10,6:7:13:9.10.11| Show InChI InChI=1S/C16H20FN/c17-14-3-1-2-11(5-14)10-18-15-6-12-4-13(8-15)9-16(18)7-12/h1-3,5,12-13,15-16H,4,6-10H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	<1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of H1 receptor by NIMH PDSP				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair
Alpha-2B adrenergic receptor (Homo sapiens (Human))	BDBM50352160 (CHEMBL1824777) Show SMILES OC12CC3CC(CC(C3)N1Cc1ccccc1)C2 |TLB:8:7:17:2.3.4,8:3:9.7.6:17,4:5:9:2.8.3,THB:4:3:9:6.5.17,10:9:17:2.3.4| Show InChI InChI=1S/C16H21NO/c18-16-9-13-6-14(10-16)8-15(7-13)17(16)11-12-4-2-1-3-5-12/h1-5,13-15,18H,6-11H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of alpha-2B adrenergic receptor by NIMH PDSP				Bioorg Med Chem Lett 21: 5289-92 (2011) Article DOI: 10.1016/j.bmcl.2011.07.028 BindingDB Entry DOI: 10.7270/Q2S46SCV
					More data for this Ligand-Target Pair