Compile Data Set for Download or QSAR

Found 60 hits Enz. Inhib. hit(s) with all data for entry = 50021217   

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
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50222175 (2-(3,4-dichlorophenyl)-N-(furan-2-ylmethyl)cyclope...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)NCc1ccco1 |t:9| Show InChI InChI=1S/C17H15Cl2NO2/c18-15-7-6-11(9-16(15)19)13-4-1-5-14(13)17(21)20-10-12-3-2-8-22-12/h2-3,6-9H,1,4-5,10H2,(H,20,21)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50222179 (CHEMBL248824 | m-tolyl 2-(3,4-dichlorophenyl)cyclo...) Show SMILES Cc1cccc(OC(=O)C2=C(CCC2)c2ccc(Cl)c(Cl)c2)c1 |t:9| Show InChI InChI=1S/C19H16Cl2O2/c1-12-4-2-5-14(10-12)23-19(22)16-7-3-6-15(16)13-8-9-17(20)18(21)11-13/h2,4-5,8-11H,3,6-7H2,1H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50222191 (2-(3,4-dichlorophenyl)-N-(2-fluoroethyl)cyclopent-...) Show SMILES FCCNC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:6| Show InChI InChI=1S/C14H14Cl2FNO/c15-12-5-4-9(8-13(12)16)10-2-1-3-11(10)14(19)18-7-6-17/h4-5,8H,1-3,6-7H2,(H,18,19)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50222184 (2-(3,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)cycl...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)NCc1cccs1 |t:9| Show InChI InChI=1S/C17H15Cl2NOS/c18-15-7-6-11(9-16(15)19)13-4-1-5-14(13)17(21)20-10-12-3-2-8-22-12/h2-3,6-9H,1,4-5,10H2,(H,20,21)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	140	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50222188 (CHEMBL401071 | phenyl 2-(3,4-dichlorophenyl)cyclop...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)Oc1ccccc1 |t:9| Show InChI InChI=1S/C18H14Cl2O2/c19-16-10-9-12(11-17(16)20)14-7-4-8-15(14)18(21)22-13-5-2-1-3-6-13/h1-3,5-6,9-11H,4,7-8H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	170	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50222183 (CHEMBL403570 | o-tolyl 2-(3,4-dichlorophenyl)cyclo...) Show SMILES Cc1ccccc1OC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:11| Show InChI InChI=1S/C19H16Cl2O2/c1-12-5-2-3-8-18(12)23-19(22)15-7-4-6-14(15)13-9-10-16(20)17(21)11-13/h2-3,5,8-11H,4,6-7H2,1H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	220	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50222182 (2-hydroxyethyl 2-(3,4-dichlorophenyl)cyclopent-1-e...) Show SMILES OCCOC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:6| Show InChI InChI=1S/C14H14Cl2O3/c15-12-5-4-9(8-13(12)16)10-2-1-3-11(10)14(18)19-7-6-17/h4-5,8,17H,1-3,6-7H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50222178 (CHEMBL403571 | thiophen-2-ylmethyl 2-(3,4-dichloro...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)OCc1cccs1 |t:9| Show InChI InChI=1S/C17H14Cl2O2S/c18-15-7-6-11(9-16(15)19)13-4-1-5-14(13)17(20)21-10-12-3-2-8-22-12/h2-3,6-9H,1,4-5,10H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50222186 (2-fluoroethyl 2-(3,4-dichlorophenyl)cyclopent-1-en...) Show SMILES FCCOC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:6| Show InChI InChI=1S/C14H13Cl2FO2/c15-12-5-4-9(8-13(12)16)10-2-1-3-11(10)14(18)19-7-6-17/h4-5,8H,1-3,6-7H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50222185 (2-(3,4-dichlorophenyl)-N-methoxycyclopent-1-enecar...) Show SMILES CONC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:5| Show InChI InChI=1S/C13H13Cl2NO2/c1-18-16-13(17)10-4-2-3-9(10)8-5-6-11(14)12(15)7-8/h5-7H,2-4H2,1H3,(H,16,17)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	830	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50222187 (CHEMBL248825 | furan-2-ylmethyl 2-(3,4-dichlorophe...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)OCc1ccco1 |t:9| Show InChI InChI=1S/C17H14Cl2O3/c18-15-7-6-11(9-16(15)19)13-4-1-5-14(13)17(20)22-10-12-3-2-8-21-12/h2-3,6-9H,1,4-5,10H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50211023 (CHEMBL245061 | methyl 2-(3,4-dichlorophenyl)cyclop...) Show SMILES COC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:4| Show InChI InChI=1S/C13H12Cl2O2/c1-17-13(16)10-4-2-3-9(10)8-5-6-11(14)12(15)7-8/h5-7H,2-4H2,1H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50222176 (CHEMBL401069 | isopropyl 2-(3,4-dichlorophenyl)cyc...) Show SMILES CC(C)OC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:6| Show InChI InChI=1S/C15H16Cl2O2/c1-9(2)19-15(18)12-5-3-4-11(12)10-6-7-13(16)14(17)8-10/h6-9H,3-5H2,1-2H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50222177 (2,2,2-trifluoroethyl 2-(3,4-dichlorophenyl)cyclope...) Show SMILES FC(F)(F)COC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:8| Show InChI InChI=1S/C14H11Cl2F3O2/c15-11-5-4-8(6-12(11)16)9-2-1-3-10(9)13(20)21-7-14(17,18)19/h4-6H,1-3,7H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50222186 (2-fluoroethyl 2-(3,4-dichlorophenyl)cyclopent-1-en...) Show SMILES FCCOC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:6| Show InChI InChI=1S/C14H13Cl2FO2/c15-12-5-4-9(8-13(12)16)10-2-1-3-11(10)14(18)19-7-6-17/h4-5,8H,1-3,6-7H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50222192 (2-(3,4-dichlorophenyl)-N-methoxy-N-methylcyclopent...) Show SMILES CON(C)C(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:6| Show InChI InChI=1S/C14H15Cl2NO2/c1-17(19-2)14(18)11-5-3-4-10(11)9-6-7-12(15)13(16)8-9/h6-8H,3-5H2,1-2H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50222191 (2-(3,4-dichlorophenyl)-N-(2-fluoroethyl)cyclopent-...) Show SMILES FCCNC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:6| Show InChI InChI=1S/C14H14Cl2FNO/c15-12-5-4-9(8-13(12)16)10-2-1-3-11(10)14(19)18-7-6-17/h4-5,8H,1-3,6-7H2,(H,18,19)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50222182 (2-hydroxyethyl 2-(3,4-dichlorophenyl)cyclopent-1-e...) Show SMILES OCCOC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:6| Show InChI InChI=1S/C14H14Cl2O3/c15-12-5-4-9(8-13(12)16)10-2-1-3-11(10)14(18)19-7-6-17/h4-5,8,17H,1-3,6-7H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50222189 (CHEMBL402924 | N-cyclobutyl-2-(3,4-dichlorophenyl)...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)NC1CCC1 |t:9| Show InChI InChI=1S/C16H17Cl2NO/c17-14-8-7-10(9-15(14)18)12-5-2-6-13(12)16(20)19-11-3-1-4-11/h7-9,11H,1-6H2,(H,19,20)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50222185 (2-(3,4-dichlorophenyl)-N-methoxycyclopent-1-enecar...) Show SMILES CONC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:5| Show InChI InChI=1S/C13H13Cl2NO2/c1-18-16-13(17)10-4-2-3-9(10)8-5-6-11(14)12(15)7-8/h5-7H,2-4H2,1H3,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50222180 ((2-(3,4-dichlorophenyl)cyclopent-1-enyl)(morpholin...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)N1CCOCC1 |t:9| Show InChI InChI=1S/C16H17Cl2NO2/c17-14-5-4-11(10-15(14)18)12-2-1-3-13(12)16(20)19-6-8-21-9-7-19/h4-5,10H,1-3,6-9H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50211023 (CHEMBL245061 | methyl 2-(3,4-dichlorophenyl)cyclop...) Show SMILES COC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:4| Show InChI InChI=1S/C13H12Cl2O2/c1-17-13(16)10-4-2-3-9(10)8-5-6-11(14)12(15)7-8/h5-7H,2-4H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50222190 (CHEMBL399430 | cyclohexyl 2-(3,4-dichlorophenyl)cy...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)OC1CCCCC1 |t:9| Show InChI InChI=1S/C18H20Cl2O2/c19-16-10-9-12(11-17(16)20)14-7-4-8-15(14)18(21)22-13-5-2-1-3-6-13/h9-11,13H,1-8H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50222175 (2-(3,4-dichlorophenyl)-N-(furan-2-ylmethyl)cyclope...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)NCc1ccco1 |t:9| Show InChI InChI=1S/C17H15Cl2NO2/c18-15-7-6-11(9-16(15)19)13-4-1-5-14(13)17(21)20-10-12-3-2-8-22-12/h2-3,6-9H,1,4-5,10H2,(H,20,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50222184 (2-(3,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)cycl...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)NCc1cccs1 |t:9| Show InChI InChI=1S/C17H15Cl2NOS/c18-15-7-6-11(9-16(15)19)13-4-1-5-14(13)17(21)20-10-12-3-2-8-22-12/h2-3,6-9H,1,4-5,10H2,(H,20,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50222187 (CHEMBL248825 | furan-2-ylmethyl 2-(3,4-dichlorophe...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)OCc1ccco1 |t:9| Show InChI InChI=1S/C17H14Cl2O3/c18-15-7-6-11(9-16(15)19)13-4-1-5-14(13)17(20)22-10-12-3-2-8-21-12/h2-3,6-9H,1,4-5,10H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	2.40E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human SERT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50222175 (2-(3,4-dichlorophenyl)-N-(furan-2-ylmethyl)cyclope...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)NCc1ccco1 |t:9| Show InChI InChI=1S/C17H15Cl2NO2/c18-15-7-6-11(9-16(15)19)13-4-1-5-14(13)17(21)20-10-12-3-2-8-22-12/h2-3,6-9H,1,4-5,10H2,(H,20,21)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	2.40E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human SERT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50222176 (CHEMBL401069 | isopropyl 2-(3,4-dichlorophenyl)cyc...) Show SMILES CC(C)OC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:6| Show InChI InChI=1S/C15H16Cl2O2/c1-9(2)19-15(18)12-5-3-4-11(12)10-6-7-13(16)14(17)8-10/h6-9H,3-5H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.60E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50222183 (CHEMBL403570 | o-tolyl 2-(3,4-dichlorophenyl)cyclo...) Show SMILES Cc1ccccc1OC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:11| Show InChI InChI=1S/C19H16Cl2O2/c1-12-5-2-3-8-18(12)23-19(22)15-7-4-6-14(15)13-9-10-16(20)17(21)11-13/h2-3,5,8-11H,4,6-7H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.30E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50222178 (CHEMBL403571 | thiophen-2-ylmethyl 2-(3,4-dichloro...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)OCc1cccs1 |t:9| Show InChI InChI=1S/C17H14Cl2O2S/c18-15-7-6-11(9-16(15)19)13-4-1-5-14(13)17(20)21-10-12-3-2-8-22-12/h2-3,6-9H,1,4-5,10H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	4.20E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50222189 (CHEMBL402924 | N-cyclobutyl-2-(3,4-dichlorophenyl)...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)NC1CCC1 |t:9| Show InChI InChI=1S/C16H17Cl2NO/c17-14-8-7-10(9-15(14)18)12-5-2-6-13(12)16(20)19-11-3-1-4-11/h7-9,11H,1-6H2,(H,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50222182 (2-hydroxyethyl 2-(3,4-dichlorophenyl)cyclopent-1-e...) Show SMILES OCCOC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:6| Show InChI InChI=1S/C14H14Cl2O3/c15-12-5-4-9(8-13(12)16)10-2-1-3-11(10)14(18)19-7-6-17/h4-5,8,17H,1-3,6-7H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human SERT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50222181 ((2-(3,4-dichlorophenyl)cyclopent-1-enyl)(pyrrolidi...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)N1CCCC1 |t:9| Show InChI InChI=1S/C16H17Cl2NO/c17-14-7-6-11(10-15(14)18)12-4-3-5-13(12)16(20)19-8-1-2-9-19/h6-7,10H,1-5,8-9H2	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.80E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50222187 (CHEMBL248825 | furan-2-ylmethyl 2-(3,4-dichlorophe...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)OCc1ccco1 |t:9| Show InChI InChI=1S/C17H14Cl2O3/c18-15-7-6-11(9-16(15)19)13-4-1-5-14(13)17(20)22-10-12-3-2-8-21-12/h2-3,6-9H,1,4-5,10H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	6.10E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50222188 (CHEMBL401071 | phenyl 2-(3,4-dichlorophenyl)cyclop...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)Oc1ccccc1 |t:9| Show InChI InChI=1S/C18H14Cl2O2/c19-16-10-9-12(11-17(16)20)14-7-4-8-15(14)18(21)22-13-5-2-1-3-6-13/h1-3,5-6,9-11H,4,7-8H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.50E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50222174 (2-(3,4-dichlorophenyl)-N,N-diethylcyclopent-1-enec...) Show SMILES CCN(CC)C(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:7| Show InChI InChI=1S/C16H19Cl2NO/c1-3-19(4-2)16(20)13-7-5-6-12(13)11-8-9-14(17)15(18)10-11/h8-10H,3-7H2,1-2H3	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.40E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human DAT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50222179 (CHEMBL248824 | m-tolyl 2-(3,4-dichlorophenyl)cyclo...) Show SMILES Cc1cccc(OC(=O)C2=C(CCC2)c2ccc(Cl)c(Cl)c2)c1 |t:9| Show InChI InChI=1S/C19H16Cl2O2/c1-12-4-2-5-14(10-12)23-19(22)16-7-3-6-15(16)13-8-9-17(20)18(21)11-13/h2,4-5,8-11H,3,6-7H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50222184 (2-(3,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)cycl...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)NCc1cccs1 |t:9| Show InChI InChI=1S/C17H15Cl2NOS/c18-15-7-6-11(9-16(15)19)13-4-1-5-14(13)17(21)20-10-12-3-2-8-22-12/h2-3,6-9H,1,4-5,10H2,(H,20,21)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.10E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human SERT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50222190 (CHEMBL399430 | cyclohexyl 2-(3,4-dichlorophenyl)cy...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)OC1CCCCC1 |t:9| Show InChI InChI=1S/C18H20Cl2O2/c19-16-10-9-12(11-17(16)20)14-7-4-8-15(14)18(21)22-13-5-2-1-3-6-13/h9-11,13H,1-8H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.30E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50222177 (2,2,2-trifluoroethyl 2-(3,4-dichlorophenyl)cyclope...) Show SMILES FC(F)(F)COC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:8| Show InChI InChI=1S/C14H11Cl2F3O2/c15-11-5-4-8(6-12(11)16)9-2-1-3-10(9)13(20)21-7-14(17,18)19/h4-6H,1-3,7H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.70E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50222174 (2-(3,4-dichlorophenyl)-N,N-diethylcyclopent-1-enec...) Show SMILES CCN(CC)C(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:7| Show InChI InChI=1S/C16H19Cl2NO/c1-3-19(4-2)16(20)13-7-5-6-12(13)11-8-9-14(17)15(18)10-11/h8-10H,3-7H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.10E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50222192 (2-(3,4-dichlorophenyl)-N-methoxy-N-methylcyclopent...) Show SMILES CON(C)C(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:6| Show InChI InChI=1S/C14H15Cl2NO2/c1-17(19-2)14(18)11-5-3-4-10(11)9-6-7-12(15)13(16)8-9/h6-8H,3-5H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50222174 (2-(3,4-dichlorophenyl)-N,N-diethylcyclopent-1-enec...) Show SMILES CCN(CC)C(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:7| Show InChI InChI=1S/C16H19Cl2NO/c1-3-19(4-2)16(20)13-7-5-6-12(13)11-8-9-14(17)15(18)10-11/h8-10H,3-7H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human SERT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50222180 ((2-(3,4-dichlorophenyl)cyclopent-1-enyl)(morpholin...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)N1CCOCC1 |t:9| Show InChI InChI=1S/C16H17Cl2NO2/c17-14-5-4-11(10-15(14)18)12-2-1-3-13(12)16(20)19-6-8-21-9-7-19/h4-5,10H,1-3,6-9H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50222186 (2-fluoroethyl 2-(3,4-dichlorophenyl)cyclopent-1-en...) Show SMILES FCCOC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:6| Show InChI InChI=1S/C14H13Cl2FO2/c15-12-5-4-9(8-13(12)16)10-2-1-3-11(10)14(18)19-7-6-17/h4-5,8H,1-3,6-7H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.90E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human SERT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50222181 ((2-(3,4-dichlorophenyl)cyclopent-1-enyl)(pyrrolidi...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)N1CCCC1 |t:9| Show InChI InChI=1S/C16H17Cl2NO/c17-14-7-6-11(10-15(14)18)12-4-3-5-13(12)16(20)19-8-1-2-9-19/h6-7,10H,1-5,8-9H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.10E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human NET transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50222183 (CHEMBL403570 | o-tolyl 2-(3,4-dichlorophenyl)cyclo...) Show SMILES Cc1ccccc1OC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:11| Show InChI InChI=1S/C19H16Cl2O2/c1-12-5-2-3-8-18(12)23-19(22)15-7-4-6-14(15)13-9-10-16(20)17(21)11-13/h2-3,5,8-11H,4,6-7H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human SERT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50222176 (CHEMBL401069 | isopropyl 2-(3,4-dichlorophenyl)cyc...) Show SMILES CC(C)OC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:6| Show InChI InChI=1S/C15H16Cl2O2/c1-9(2)19-15(18)12-5-3-4-11(12)10-6-7-13(16)14(17)8-10/h6-9H,3-5H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human SERT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50222188 (CHEMBL401071 | phenyl 2-(3,4-dichlorophenyl)cyclop...) Show SMILES Clc1ccc(cc1Cl)C1=C(CCC1)C(=O)Oc1ccccc1 |t:9| Show InChI InChI=1S/C18H14Cl2O2/c19-16-10-9-12(11-17(16)20)14-7-4-8-15(14)18(21)22-13-5-2-1-3-6-13/h1-3,5-6,9-11H,4,7-8H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human SERT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50222185 (2-(3,4-dichlorophenyl)-N-methoxycyclopent-1-enecar...) Show SMILES CONC(=O)C1=C(CCC1)c1ccc(Cl)c(Cl)c1 |t:5| Show InChI InChI=1S/C13H13Cl2NO2/c1-18-16-13(17)10-4-2-3-9(10)8-5-6-11(14)12(15)7-8/h5-7H,2-4H2,1H3,(H,16,17)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Aarhus Curated by ChEMBL					Assay Description Displacement of [125I]RTI55 from human SERT transfected in COS1 cells				Bioorg Med Chem Lett 17: 6019-25 (2007) Article DOI: 10.1016/j.bmcl.2007.07.076 BindingDB Entry DOI: 10.7270/Q24X57HP
					More data for this Ligand-Target Pair

Displayed 1 to 50 (of 60 total )  |  Next  |  Last  >>

Jump to: