Compile Data Set for Download or QSAR

Found 101 hits with Last Name = 'chua' and Initial = 'sw'   

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 (RAT)	BDBM21398 (4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...) Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	0.900	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 rat brain homogenate				Bioorg Med Chem Lett 21: 3622-6 (2011) Article DOI: 10.1016/j.bmcl.2011.04.098 BindingDB Entry DOI: 10.7270/Q2ZS2WTH
					More data for this Ligand-Target Pair				3D Structure (crystal)
D(2) dopamine receptor (Homo sapiens (Human))	BDBM21398 (4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...) Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	DrugBank Article PubMed	1	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]N-methylspiperone from human D2 receptor expressed in HEK cells				Bioorg Med Chem Lett 21: 3622-6 (2011) Article DOI: 10.1016/j.bmcl.2011.04.098 BindingDB Entry DOI: 10.7270/Q2ZS2WTH
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50170660 (CHEMBL190883 | CHEMBL521582 | N,N-dipropyl-2-[4-me...) Show SMILES CCCN(CCC)CCc1ccc(OC)c(OCCc2ccccc2)c1 Show InChI InChI=1S/C23H33NO2/c1-4-15-24(16-5-2)17-13-21-11-12-22(25-3)23(19-21)26-18-14-20-9-7-6-8-10-20/h6-12,19H,4-5,13-18H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	1.03	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 rat brain homogenate				Bioorg Med Chem Lett 21: 3622-6 (2011) Article DOI: 10.1016/j.bmcl.2011.04.098 BindingDB Entry DOI: 10.7270/Q2ZS2WTH
					More data for this Ligand-Target Pair				3D Structure (crystal)
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50354654 (CHEMBL1833977) Show SMILES COc1ccc(CCCN2CCN(Cc3cc4ccccc4o3)CC2)cc1 Show InChI InChI=1S/C23H28N2O2/c1-26-21-10-8-19(9-11-21)5-4-12-24-13-15-25(16-14-24)18-22-17-20-6-2-3-7-23(20)27-22/h2-3,6-11,17H,4-5,12-16,18H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.10	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 rat brain homogenate after 2.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50354662 (CHEMBL1834258) Show SMILES C(CCc1ccccc1)CN1CCN(Cc2cc3ccccc3o2)CC1 Show InChI InChI=1S/C23H28N2O/c1-2-8-20(9-3-1)10-6-7-13-24-14-16-25(17-15-24)19-22-18-21-11-4-5-12-23(21)26-22/h1-5,8-9,11-12,18H,6-7,10,13-17,19H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.20	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 rat brain homogenate after 2.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM21398 (4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...) Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	5	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]N-methylspiperone from human D4 receptor expressed in HEK cells				Bioorg Med Chem Lett 21: 3622-6 (2011) Article DOI: 10.1016/j.bmcl.2011.04.098 BindingDB Entry DOI: 10.7270/Q2ZS2WTH
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50354659 (CHEMBL1834255) Show SMILES C(CN1CCN(Cc2cc3ccccc3o2)CC1)Cc1ccccc1 Show InChI InChI=1S/C22H26N2O/c1-2-7-19(8-3-1)9-6-12-23-13-15-24(16-14-23)18-21-17-20-10-4-5-11-22(20)25-21/h1-5,7-8,10-11,17H,6,9,12-16,18H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.70	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 rat brain homogenate after 2.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50354661 (CHEMBL1834257) Show SMILES COc1cccc(CCCN2CCN(Cc3cc4ccccc4o3)CC2)c1 Show InChI InChI=1S/C23H28N2O2/c1-26-21-9-4-6-19(16-21)7-5-11-24-12-14-25(15-13-24)18-22-17-20-8-2-3-10-23(20)27-22/h2-4,6,8-10,16-17H,5,7,11-15,18H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.70	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 rat brain homogenate after 2.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair
Translocator protein (Homo sapiens (Human))	BDBM50327238 (2-[2-(4'-Methoxyphenyl)-5,7-dimethylpyrazolo[1,5-a...) Show SMILES CCN(CC)C(=O)Cc1c(nn2c(C)cc(C)nc12)-c1ccc(OC)cc1 Show InChI InChI=1S/C21H26N4O2/c1-6-24(7-2)19(26)13-18-20(16-8-10-17(27-5)11-9-16)23-25-15(4)12-14(3)22-21(18)25/h8-12H,6-7,13H2,1-5H3	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	6.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of New South Wales Curated by ChEMBL					Assay Description Displacement of [3H]PK11195 from TSPO in human T98G cell membranes incubated for 90 mins by competition radioligand binding assay				J Med Chem 58: 8743-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b01288 BindingDB Entry DOI: 10.7270/Q2Q24222
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50354655 (CHEMBL1834251) Show SMILES C(Cc1ccccc1)N1CCN(Cc2cc3ccccc3o2)CC1 Show InChI InChI=1S/C21H24N2O/c1-2-6-18(7-3-1)10-11-22-12-14-23(15-13-22)17-20-16-19-8-4-5-9-21(19)24-20/h1-9,16H,10-15,17H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.30	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 rat brain homogenate after 2.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50354664 (CHEMBL1834260) Show SMILES COc1cccc(CCCCN2CCN(Cc3cc4ccccc4o3)CC2)c1 Show InChI InChI=1S/C24H30N2O2/c1-27-22-10-6-8-20(17-22)7-4-5-12-25-13-15-26(16-14-25)19-23-18-21-9-2-3-11-24(21)28-23/h2-3,6,8-11,17-18H,4-5,7,12-16,19H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.60	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 rat brain homogenate after 2.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50344628 (CHEMBL1779060 | N-(2-(2-methoxy-5-methylbenzamido)...) Show SMILES COc1ccc(C)cc1C(=O)NCCN1C2C3C4C5C3C1(O)C1C5CC4C21 |TLB:15:26:17.18:24,20:22:17.18:24,THB:16:17:26.22:24,25:26:16.19:14,17:16:26.22:14,19:18:26.22:24,23:22:16.19:14,18:19:26.22:14,13:14:16.19:26.22| Show InChI InChI=1S/C22H26N2O3/c1-9-3-4-13(27-2)10(7-9)21(25)23-5-6-24-20-16-11-8-12-15-14(11)17(20)19(15)22(24,26)18(12)16/h3-4,7,11-12,14-20,26H,5-6,8H2,1-2H3,(H,23,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	7.60	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 rat brain homogenate				Bioorg Med Chem Lett 21: 3622-6 (2011) Article DOI: 10.1016/j.bmcl.2011.04.098 BindingDB Entry DOI: 10.7270/Q2ZS2WTH
					More data for this Ligand-Target Pair
Translocator protein (Homo sapiens (Human))	BDBM50327238 (2-[2-(4'-Methoxyphenyl)-5,7-dimethylpyrazolo[1,5-a...) Show SMILES CCN(CC)C(=O)Cc1c(nn2c(C)cc(C)nc12)-c1ccc(OC)cc1 Show InChI InChI=1S/C21H26N4O2/c1-6-24(7-2)19(26)13-18-20(16-8-10-17(27-5)11-9-16)23-25-15(4)12-14(3)22-21(18)25/h8-12H,6-7,13H2,1-5H3	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	8.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of New South Wales Curated by ChEMBL					Assay Description Inhibition constant against Adenosine A2a receptor				J Med Chem 58: 8743-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b01288 BindingDB Entry DOI: 10.7270/Q2Q24222
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50354660 (CHEMBL1834256) Show SMILES COc1ccccc1CCCN1CCN(Cc2cc3ccccc3o2)CC1 Show InChI InChI=1S/C23H28N2O2/c1-26-22-10-4-2-7-19(22)9-6-12-24-13-15-25(16-14-24)18-21-17-20-8-3-5-11-23(20)27-21/h2-5,7-8,10-11,17H,6,9,12-16,18H2,1H3	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 rat brain homogenate after 2.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair
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 (RAT)	BDBM50354658 (CHEMBL1834254) Show SMILES COc1ccc(CCN2CCN(Cc3cc4ccccc4o3)CC2)cc1 Show InChI InChI=1S/C22H26N2O2/c1-25-20-8-6-18(7-9-20)10-11-23-12-14-24(15-13-23)17-21-16-19-4-2-3-5-22(19)26-21/h2-9,16H,10-15,17H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.40	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 rat brain homogenate after 2.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					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))	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 (RAT)	BDBM50354657 (CHEMBL1834253) Show SMILES COc1cccc(CCN2CCN(Cc3cc4ccccc4o3)CC2)c1 Show InChI InChI=1S/C22H26N2O2/c1-25-20-7-4-5-18(15-20)9-10-23-11-13-24(14-12-23)17-21-16-19-6-2-3-8-22(19)26-21/h2-8,15-16H,9-14,17H2,1H3	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 rat brain homogenate after 2.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					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 (RAT)	BDBM50354665 (CHEMBL1834261) Show SMILES COc1ccc(CCCCN2CCN(Cc3cc4ccccc4o3)CC2)cc1 Show InChI InChI=1S/C24H30N2O2/c1-27-22-11-9-20(10-12-22)6-4-5-13-25-14-16-26(17-15-25)19-23-18-21-7-2-3-8-24(21)28-23/h2-3,7-12,18H,4-6,13-17,19H2,1H3	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 rat brain homogenate after 2.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50354663 (CHEMBL1834259) Show SMILES COc1ccccc1CCCCN1CCN(Cc2cc3ccccc3o2)CC1 Show InChI InChI=1S/C24H30N2O2/c1-27-23-11-4-2-8-20(23)9-6-7-13-25-14-16-26(17-15-25)19-22-18-21-10-3-5-12-24(21)28-22/h2-5,8,10-12,18H,6-7,9,13-17,19H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	16	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 rat brain homogenate after 2.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50354656 (CHEMBL1834252) Show SMILES COc1ccccc1CCN1CCN(Cc2cc3ccccc3o2)CC1 Show InChI InChI=1S/C22H26N2O2/c1-25-21-8-4-2-6-18(21)10-11-23-12-14-24(15-13-23)17-20-16-19-7-3-5-9-22(19)26-20/h2-9,16H,10-15,17H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	17	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 rat brain homogenate after 2.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50344629 (CHEMBL1779059 | N-(2-(4-methoxy-3-phenethoxyphenyl...) Show SMILES COc1ccc(CCN2C3C4C5C6C4C2(O)C2C6CC5C32)cc1OCCc1ccccc1 |TLB:9:20:11.12:18,14:16:11.12:18,THB:10:11:20.16:18,19:20:10.13:8,11:10:20.16:8,13:12:20.16:18,17:16:10.13:8,12:13:20.16:8,7:8:10.13:20.16| Show InChI InChI=1S/C28H31NO3/c1-31-19-8-7-16(13-20(19)32-12-10-15-5-3-2-4-6-15)9-11-29-27-23-17-14-18-22-21(17)24(27)26(22)28(29,30)25(18)23/h2-8,13,17-18,21-27,30H,9-12,14H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	20	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 rat brain homogenate				Bioorg Med Chem Lett 21: 3622-6 (2011) Article DOI: 10.1016/j.bmcl.2011.04.098 BindingDB Entry DOI: 10.7270/Q2ZS2WTH
					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
D(1A) dopamine receptor (Homo sapiens (Human))	BDBM21398 (4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...) Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	DrugBank Article PubMed	25	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]SCH233930 from human D1 receptor expressed in HEK cells				Bioorg Med Chem Lett 21: 3622-6 (2011) Article DOI: 10.1016/j.bmcl.2011.04.098 BindingDB Entry DOI: 10.7270/Q2ZS2WTH
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50344630 (CHEMBL1779058 | N-(4-(4-Fluoro)butyrophenone)-4-az...) Show SMILES OC12C3C4C5C3C(C3C5CC4C13)N2CCCC(=O)c1ccc(F)cc1 |TLB:6:7:4.3:9,8:7:5.2:12,4:5:7.11:12,1:11:4.3:9,10:11:5.2:12,3:2:7.11:12,THB:5:4:7.11:9,2:3:7.11:9,13:12:5.2:7.11| Show InChI InChI=1S/C21H22FNO2/c22-10-5-3-9(4-6-10)13(24)2-1-7-23-20-16-11-8-12-15-14(11)17(20)19(15)21(23,25)18(12)16/h3-6,11-12,14-20,25H,1-2,7-8H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	27	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 rat brain homogenate				Bioorg Med Chem Lett 21: 3622-6 (2011) Article DOI: 10.1016/j.bmcl.2011.04.098 BindingDB Entry DOI: 10.7270/Q2ZS2WTH
					More data for this Ligand-Target Pair
Translocator protein (Homo sapiens (Human))	BDBM50131400 (CHEMBL3634876) Show SMILES CCN(CC)C(=O)Cn1c(cc2c(C)cc(C)cc12)-c1ccc(OC)cc1 Show InChI InChI=1S/C23H28N2O2/c1-6-24(7-2)23(26)15-25-21(18-8-10-19(27-5)11-9-18)14-20-17(4)12-16(3)13-22(20)25/h8-14H,6-7,15H2,1-5H3	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	28	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of New South Wales Curated by ChEMBL					Assay Description Inhibition constant against Adenosine A2a receptor				J Med Chem 58: 8743-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b01288 BindingDB Entry DOI: 10.7270/Q2Q24222
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM21398 (4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...) Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents 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]N-methylspiperone from human D3 receptor expressed in HEK cells				Bioorg Med Chem Lett 21: 3622-6 (2011) Article DOI: 10.1016/j.bmcl.2011.04.098 BindingDB Entry DOI: 10.7270/Q2ZS2WTH
					More data for this Ligand-Target Pair
Translocator protein (Homo sapiens (Human))	BDBM50131380 (CHEMBL3634878) Show SMILES CCN(CC)C(=O)Cn1c(nc2c(C)cc(C)nc12)-c1ccc(OC)cc1 Show InChI InChI=1S/C21H26N4O2/c1-6-24(7-2)18(26)13-25-20(16-8-10-17(27-5)11-9-16)23-19-14(3)12-15(4)22-21(19)25/h8-12H,6-7,13H2,1-5H3	KEGG UniProtKB/SwissProt DrugBank antibodypedia 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
University of New South Wales Curated by ChEMBL					Assay Description Displacement of [3H]PK11195 from TSPO in human T98G cell membranes incubated for 90 mins by competition radioligand binding assay				J Med Chem 58: 8743-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b01288 BindingDB Entry DOI: 10.7270/Q2Q24222
					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
D(1B) dopamine receptor (Homo sapiens (Human))	BDBM21398 (4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...) Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	48	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]SCH233930 from human D5 receptor expressed in HEK cells				Bioorg Med Chem Lett 21: 3622-6 (2011) Article DOI: 10.1016/j.bmcl.2011.04.098 BindingDB Entry DOI: 10.7270/Q2ZS2WTH
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50354662 (CHEMBL1834258) Show SMILES C(CCc1ccccc1)CN1CCN(Cc2cc3ccccc3o2)CC1 Show InChI InChI=1S/C23H28N2O/c1-2-8-20(9-3-1)10-6-7-13-24-14-16-25(17-15-24)19-22-18-21-11-4-5-12-23(21)26-22/h1-5,8-9,11-12,18H,6-7,10,13-17,19H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	89	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]N-methylspiperone from D2 after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50344630 (CHEMBL1779058 | N-(4-(4-Fluoro)butyrophenone)-4-az...) Show SMILES OC12C3C4C5C3C(C3C5CC4C13)N2CCCC(=O)c1ccc(F)cc1 |TLB:6:7:4.3:9,8:7:5.2:12,4:5:7.11:12,1:11:4.3:9,10:11:5.2:12,3:2:7.11:12,THB:5:4:7.11:9,2:3:7.11:9,13:12:5.2:7.11| Show InChI InChI=1S/C21H22FNO2/c22-10-5-3-9(4-6-10)13(24)2-1-7-23-20-16-11-8-12-15-14(11)17(20)19(15)21(23,25)18(12)16/h3-6,11-12,14-20,25H,1-2,7-8H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	93	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]N-methylspiperone from human D4 receptor expressed in HEK cells				Bioorg Med Chem Lett 21: 3622-6 (2011) Article DOI: 10.1016/j.bmcl.2011.04.098 BindingDB Entry DOI: 10.7270/Q2ZS2WTH
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50354656 (CHEMBL1834252) Show SMILES COc1ccccc1CCN1CCN(Cc2cc3ccccc3o2)CC1 Show InChI InChI=1S/C22H26N2O2/c1-25-21-8-4-2-6-18(21)10-11-23-12-14-24(15-13-23)17-20-16-19-7-3-5-9-22(19)26-20/h2-9,16H,10-15,17H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	120	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]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair
Translocator protein (Homo sapiens (Human))	BDBM50131380 (CHEMBL3634878) Show SMILES CCN(CC)C(=O)Cn1c(nc2c(C)cc(C)nc12)-c1ccc(OC)cc1 Show InChI InChI=1S/C21H26N4O2/c1-6-24(7-2)18(26)13-25-20(16-8-10-17(27-5)11-9-16)23-19-14(3)12-15(4)22-21(19)25/h8-12H,6-7,13H2,1-5H3	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	144	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of New South Wales Curated by ChEMBL					Assay Description Inhibition constant against Adenosine A2a receptor				J Med Chem 58: 8743-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b01288 BindingDB Entry DOI: 10.7270/Q2Q24222
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50354659 (CHEMBL1834255) Show SMILES C(CN1CCN(Cc2cc3ccccc3o2)CC1)Cc1ccccc1 Show InChI InChI=1S/C22H26N2O/c1-2-7-19(8-3-1)9-6-12-23-13-15-24(16-14-23)18-21-17-20-10-4-5-11-22(20)25-21/h1-5,7-8,10-11,17H,6,9,12-16,18H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	147	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]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50354654 (CHEMBL1833977) Show SMILES COc1ccc(CCCN2CCN(Cc3cc4ccccc4o3)CC2)cc1 Show InChI InChI=1S/C23H28N2O2/c1-26-21-10-8-19(9-11-21)5-4-12-24-13-15-25(16-14-24)18-22-17-20-6-2-3-7-23(20)27-22/h2-3,6-11,17H,4-5,12-16,18H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	155	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]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (Homo sapiens (Human))	BDBM50344630 (CHEMBL1779058 | N-(4-(4-Fluoro)butyrophenone)-4-az...) Show SMILES OC12C3C4C5C3C(C3C5CC4C13)N2CCCC(=O)c1ccc(F)cc1 |TLB:6:7:4.3:9,8:7:5.2:12,4:5:7.11:12,1:11:4.3:9,10:11:5.2:12,3:2:7.11:12,THB:5:4:7.11:9,2:3:7.11:9,13:12:5.2:7.11| Show InChI InChI=1S/C21H22FNO2/c22-10-5-3-9(4-6-10)13(24)2-1-7-23-20-16-11-8-12-15-14(11)17(20)19(15)21(23,25)18(12)16/h3-6,11-12,14-20,25H,1-2,7-8H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	209	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]SCH233930 from human D1 receptor expressed in HEK cells				Bioorg Med Chem Lett 21: 3622-6 (2011) Article DOI: 10.1016/j.bmcl.2011.04.098 BindingDB Entry DOI: 10.7270/Q2ZS2WTH
					More data for this Ligand-Target Pair
Translocator protein (Homo sapiens (Human))	BDBM50131399 (CHEMBL3634877) Show SMILES CCN(CC)C(=O)Cn1c(nc2c(C)cc(C)cc12)-c1ccc(OC)cc1 Show InChI InChI=1S/C22H27N3O2/c1-6-24(7-2)20(26)14-25-19-13-15(3)12-16(4)21(19)23-22(25)17-8-10-18(27-5)11-9-17/h8-13H,6-7,14H2,1-5H3	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	224	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of New South Wales Curated by ChEMBL					Assay Description Displacement of [3H]PK11195 from TSPO in human T98G cell membranes incubated for 90 mins by competition radioligand binding assay				J Med Chem 58: 8743-9 (2015) Article DOI: 10.1021/acs.jmedchem.5b01288 BindingDB Entry DOI: 10.7270/Q2Q24222
					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
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50354661 (CHEMBL1834257) Show SMILES COc1cccc(CCCN2CCN(Cc3cc4ccccc4o3)CC2)c1 Show InChI InChI=1S/C23H28N2O2/c1-26-21-9-4-6-19(16-21)7-5-11-24-12-14-25(15-13-24)18-22-17-20-8-2-3-10-23(20)27-22/h2-4,6,8-10,16-17H,5,7,11-15,18H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	243	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]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					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
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50354662 (CHEMBL1834258) Show SMILES C(CCc1ccccc1)CN1CCN(Cc2cc3ccccc3o2)CC1 Show InChI InChI=1S/C23H28N2O/c1-2-8-20(9-3-1)10-6-7-13-24-14-16-25(17-15-24)19-22-18-21-11-4-5-12-23(21)26-22/h1-5,8-9,11-12,18H,6-7,10,13-17,19H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	275	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]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50354657 (CHEMBL1834253) Show SMILES COc1cccc(CCN2CCN(Cc3cc4ccccc4o3)CC2)c1 Show InChI InChI=1S/C22H26N2O2/c1-25-20-7-4-5-18(15-20)9-10-23-11-13-24(14-12-23)17-21-16-19-6-2-3-8-22(19)26-21/h2-8,15-16H,9-14,17H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	290	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]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50354655 (CHEMBL1834251) Show SMILES C(Cc1ccccc1)N1CCN(Cc2cc3ccccc3o2)CC1 Show InChI InChI=1S/C21H24N2O/c1-2-6-18(7-3-1)10-11-22-12-14-23(15-13-22)17-20-16-19-8-4-5-9-21(19)24-20/h1-9,16H,10-15,17H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	310	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]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50354663 (CHEMBL1834259) Show SMILES COc1ccccc1CCCCN1CCN(Cc2cc3ccccc3o2)CC1 Show InChI InChI=1S/C24H30N2O2/c1-27-23-11-4-2-8-20(23)9-6-7-13-25-14-16-26(17-15-25)19-22-18-21-10-3-5-12-24(21)28-22/h2-5,8,10-12,18H,6-7,9,13-17,19H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	332	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]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50354664 (CHEMBL1834260) Show SMILES COc1cccc(CCCCN2CCN(Cc3cc4ccccc4o3)CC2)c1 Show InChI InChI=1S/C24H30N2O2/c1-27-22-10-6-8-20(17-22)7-4-5-12-25-13-15-26(16-14-25)19-23-18-21-9-2-3-11-24(21)28-23/h2-3,6,8-11,17-18H,4-5,7,12-16,19H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	343	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]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50354665 (CHEMBL1834261) Show SMILES COc1ccc(CCCCN2CCN(Cc3cc4ccccc4o3)CC2)cc1 Show InChI InChI=1S/C24H30N2O2/c1-27-22-11-9-20(10-12-22)6-4-5-13-25-14-16-26(17-15-25)19-23-18-21-7-2-3-8-24(21)28-23/h2-3,7-12,18H,4-6,13-17,19H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	352	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]LSD from 5-HT2B after 1.5 hrs by liquid scintillation counting				Bioorg Med Chem Lett 21: 5707-10 (2011) Article DOI: 10.1016/j.bmcl.2011.08.029 BindingDB Entry DOI: 10.7270/Q20Z73P4
					More data for this Ligand-Target Pair

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