Compile Data Set for Download or QSAR

Found 111 hits with Last Name = 'fei' and Initial = 'xs'   

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
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50109929 (7-({2-[4-(2,3-Dichloro-phenyl)-piperazin-1-yl]-eth...) Show SMILES CCCN(CCN1CCN(CC1)c1cccc(Cl)c1Cl)C1CCc2ccc(O)cc2C1 Show InChI InChI=1S/C25H33Cl2N3O/c1-2-10-29(21-8-6-19-7-9-22(31)18-20(19)17-21)14-11-28-12-15-30(16-13-28)24-5-3-4-23(26)25(24)27/h3-5,7,9,18,21,31H,2,6,8,10-17H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D3 in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50109931 ((+)-7-{[4-(4-phenylpiperazin-1-yl)butyl]prop-2-yny...) Show SMILES Oc1ccc2CCC(Cc2c1)N(CCCCN1CCN(CC1)c1ccccc1)CC#C Show InChI InChI=1S/C27H35N3O/c1-2-14-29(26-12-10-23-11-13-27(31)22-24(23)21-26)16-7-6-15-28-17-19-30(20-18-28)25-8-4-3-5-9-25/h1,3-5,8-9,11,13,22,26,31H,6-7,10,12,14-21H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D3 in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50109926 (7-((2-(4-phenylpiperazin-1-yl)ethyl)(propyl)amino)...) Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2ccc(O)cc2C1 Show InChI InChI=1S/C25H35N3O/c1-2-12-27(24-10-8-21-9-11-25(29)20-22(21)19-24)16-13-26-14-17-28(18-15-26)23-6-4-3-5-7-23/h3-7,9,11,20,24,29H,2,8,10,12-19H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D3 in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50109930 (7-({4-[4-(2,3-Dichloro-phenyl)-piperazin-1-yl]-but...) Show SMILES CCCN(CCCCN1CCN(CC1)c1cccc(Cl)c1Cl)C1CCc2ccc(O)cc2C1 Show InChI InChI=1S/C27H37Cl2N3O/c1-2-12-31(23-10-8-21-9-11-24(33)20-22(21)19-23)14-4-3-13-30-15-17-32(18-16-30)26-7-5-6-25(28)27(26)29/h5-7,9,11,20,23,33H,2-4,8,10,12-19H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D3 in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50109925 (7-({4-[4-(2,3-Dichloro-phenyl)-piperazin-1-yl]-but...) Show SMILES Oc1ccc2CCC(Cc2c1)N(CCCCN1CCN(CC1)c1cccc(Cl)c1Cl)CC#C Show InChI InChI=1S/C27H33Cl2N3O/c1-2-12-31(23-10-8-21-9-11-24(33)20-22(21)19-23)14-4-3-13-30-15-17-32(18-16-30)26-7-5-6-25(28)27(26)29/h1,5-7,9,11,20,23,33H,3-4,8,10,12-19H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D3 in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50109927 ((+)-7-[(4-(4-phenylpiperazin-1-yl)butyl)(propyl)am...) Show SMILES CCCN(CCCCN1CCN(CC1)c1ccccc1)C1CCc2ccc(O)cc2C1 Show InChI InChI=1S/C27H39N3O/c1-2-14-29(26-12-10-23-11-13-27(31)22-24(23)21-26)16-7-6-15-28-17-19-30(20-18-28)25-8-4-3-5-9-25/h3-5,8-9,11,13,22,26,31H,2,6-7,10,12,14-21H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D3 in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50109925 (7-({4-[4-(2,3-Dichloro-phenyl)-piperazin-1-yl]-but...) Show SMILES Oc1ccc2CCC(Cc2c1)N(CCCCN1CCN(CC1)c1cccc(Cl)c1Cl)CC#C Show InChI InChI=1S/C27H33Cl2N3O/c1-2-12-31(23-10-8-21-9-11-24(33)20-22(21)19-23)14-4-3-13-30-15-17-32(18-16-30)26-7-5-6-25(28)27(26)29/h1,5-7,9,11,20,23,33H,3-4,8,10,12-19H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	7.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D2L in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50109930 (7-({4-[4-(2,3-Dichloro-phenyl)-piperazin-1-yl]-but...) Show SMILES CCCN(CCCCN1CCN(CC1)c1cccc(Cl)c1Cl)C1CCc2ccc(O)cc2C1 Show InChI InChI=1S/C27H37Cl2N3O/c1-2-12-31(23-10-8-21-9-11-24(33)20-22(21)19-23)14-4-3-13-30-15-17-32(18-16-30)26-7-5-6-25(28)27(26)29/h5-7,9,11,20,23,33H,2-4,8,10,12-19H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	8.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D2L in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50109928 (7-{[2-(4-Phenyl-piperazin-1-yl)-ethyl]-prop-2-ynyl...) Show SMILES Oc1ccc2CCC(Cc2c1)N(CCN1CCN(CC1)c1ccccc1)CC#C Show InChI InChI=1S/C25H31N3O/c1-2-12-27(24-10-8-21-9-11-25(29)20-22(21)19-24)16-13-26-14-17-28(18-15-26)23-6-4-3-5-7-23/h1,3-7,9,11,20,24,29H,8,10,12-19H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D3 in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50109929 (7-({2-[4-(2,3-Dichloro-phenyl)-piperazin-1-yl]-eth...) Show SMILES CCCN(CCN1CCN(CC1)c1cccc(Cl)c1Cl)C1CCc2ccc(O)cc2C1 Show InChI InChI=1S/C25H33Cl2N3O/c1-2-10-29(21-8-6-19-7-9-22(31)18-20(19)17-21)14-11-28-12-15-30(16-13-28)24-5-3-4-23(26)25(24)27/h3-5,7,9,18,21,31H,2,6,8,10-17H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	27	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D2L in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50109923 (4-{(7-Hydroxy-1,2,3,4-tetrahydro-naphthalen-2-yl)-...) Show SMILES Oc1ccc2CCC(Cc2c1)N(CCCC#N)CCCN1CCN(CC1)c1ccccc1 Show InChI InChI=1S/C27H36N4O/c28-13-4-5-15-30(26-11-9-23-10-12-27(32)22-24(23)21-26)16-6-14-29-17-19-31(20-18-29)25-7-2-1-3-8-25/h1-3,7-8,10,12,22,26,32H,4-6,9,11,14-21H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	50	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D3 in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50109922 (CHEMBL422883 | N-(2-{(7-Hydroxy-1,2,3,4-tetrahydro...) Show SMILES Oc1ccc2CCC(Cc2c1)N(CCCN1CCN(CC1)c1ccccc1)CCNC(=O)c1ccccc1 Show InChI InChI=1S/C32H40N4O2/c37-31-15-13-26-12-14-30(24-28(26)25-31)35(19-16-33-32(38)27-8-3-1-4-9-27)18-7-17-34-20-22-36(23-21-34)29-10-5-2-6-11-29/h1-6,8-11,13,15,25,30,37H,7,12,14,16-24H2,(H,33,38)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	56	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D3 in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50109931 ((+)-7-{[4-(4-phenylpiperazin-1-yl)butyl]prop-2-yny...) Show SMILES Oc1ccc2CCC(Cc2c1)N(CCCCN1CCN(CC1)c1ccccc1)CC#C Show InChI InChI=1S/C27H35N3O/c1-2-14-29(26-12-10-23-11-13-27(31)22-24(23)21-26)16-7-6-15-28-17-19-30(20-18-28)25-8-4-3-5-9-25/h1,3-5,8-9,11,13,22,26,31H,6-7,10,12,14-21H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	68	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D2L in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50109927 ((+)-7-[(4-(4-phenylpiperazin-1-yl)butyl)(propyl)am...) Show SMILES CCCN(CCCCN1CCN(CC1)c1ccccc1)C1CCc2ccc(O)cc2C1 Show InChI InChI=1S/C27H39N3O/c1-2-14-29(26-12-10-23-11-13-27(31)22-24(23)21-26)16-7-6-15-28-17-19-30(20-18-28)25-8-4-3-5-9-25/h3-5,8-9,11,13,22,26,31H,2,6-7,10,12,14-21H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	114	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D2L in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50109926 (7-((2-(4-phenylpiperazin-1-yl)ethyl)(propyl)amino)...) Show SMILES CCCN(CCN1CCN(CC1)c1ccccc1)C1CCc2ccc(O)cc2C1 Show InChI InChI=1S/C25H35N3O/c1-2-12-27(24-10-8-21-9-11-25(29)20-22(21)19-24)16-13-26-14-17-28(18-15-26)23-6-4-3-5-7-23/h3-7,9,11,20,24,29H,2,8,10,12-19H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	213	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D2L in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50109928 (7-{[2-(4-Phenyl-piperazin-1-yl)-ethyl]-prop-2-ynyl...) Show SMILES Oc1ccc2CCC(Cc2c1)N(CCN1CCN(CC1)c1ccccc1)CC#C Show InChI InChI=1S/C25H31N3O/c1-2-12-27(24-10-8-21-9-11-25(29)20-22(21)19-24)16-13-26-14-17-28(18-15-26)23-6-4-3-5-7-23/h1,3-7,9,11,20,24,29H,8,10,12-19H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	245	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D2L in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50109922 (CHEMBL422883 | N-(2-{(7-Hydroxy-1,2,3,4-tetrahydro...) Show SMILES Oc1ccc2CCC(Cc2c1)N(CCCN1CCN(CC1)c1ccccc1)CCNC(=O)c1ccccc1 Show InChI InChI=1S/C32H40N4O2/c37-31-15-13-26-12-14-30(24-28(26)25-31)35(19-16-33-32(38)27-8-3-1-4-9-27)18-7-17-34-20-22-36(23-21-34)29-10-5-2-6-11-29/h1-6,8-11,13,15,25,30,37H,7,12,14,16-24H2,(H,33,38)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	354	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D2L in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50109923 (4-{(7-Hydroxy-1,2,3,4-tetrahydro-naphthalen-2-yl)-...) Show SMILES Oc1ccc2CCC(Cc2c1)N(CCCC#N)CCCN1CCN(CC1)c1ccccc1 Show InChI InChI=1S/C27H36N4O/c28-13-4-5-15-30(26-11-9-23-10-12-27(32)22-24(23)21-26)16-6-14-29-17-19-31(20-18-29)25-7-2-1-3-8-25/h1-3,7-8,10,12,22,26,32H,4-6,9,11,14-21H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	622	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D2L in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50109924 (CHEMBL156816 | N-(4-{(7-Hydroxy-1,2,3,4-tetrahydro...) Show SMILES Oc1ccc2CCC(Cc2c1)N(CCCCNC(=O)c1ccccc1)CCCN1CCN(CC1)c1ccccc1 Show InChI InChI=1S/C34H44N4O2/c39-33-17-15-28-14-16-32(26-30(28)27-33)37(20-8-7-18-35-34(40)29-10-3-1-4-11-29)21-9-19-36-22-24-38(25-23-36)31-12-5-2-6-13-31/h1-6,10-13,15,17,27,32,39H,7-9,14,16,18-26H2,(H,35,40)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	756	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D3 in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50109924 (CHEMBL156816 | N-(4-{(7-Hydroxy-1,2,3,4-tetrahydro...) Show SMILES Oc1ccc2CCC(Cc2c1)N(CCCCNC(=O)c1ccccc1)CCCN1CCN(CC1)c1ccccc1 Show InChI InChI=1S/C34H44N4O2/c39-33-17-15-28-14-16-32(26-30(28)27-33)37(20-8-7-18-35-34(40)29-10-3-1-4-11-29)21-9-19-36-22-24-38(25-23-36)31-12-5-2-6-13-31/h1-6,10-13,15,17,27,32,39H,7-9,14,16,18-26H2,(H,35,40)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	782	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Tested for the binding constant against cloned human Dopamine receptor D2L in HEK cells by displacing [3H]-spiperone				Bioorg Med Chem Lett 12: 619-22 (2002) BindingDB Entry DOI: 10.7270/Q25X287P
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50108815 (4-(2-Benzhydryloxy-ethyl)-1-(4-iodo-benzyl)-piperi...) Show SMILES Ic1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C27H30INO/c28-26-13-11-23(12-14-26)21-29-18-15-22(16-19-29)17-20-30-27(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,22,27H,15-21H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.960	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Inhibition of 3[H] WIN-35 428 binding to Dopamine transporter (DAT)				J Med Chem 45: 654-62 (2002) BindingDB Entry DOI: 10.7270/Q2FJ2HHV
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50108818 (4-(2-Benzhydryloxy-ethyl)-1-(4-vinyl-benzyl)-piper...) Show SMILES C=Cc1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C29H33NO/c1-2-24-13-15-26(16-14-24)23-30-20-17-25(18-21-30)19-22-31-29(27-9-5-3-6-10-27)28-11-7-4-8-12-28/h2-16,25,29H,1,17-23H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.96	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Inhibition of 3[H] WIN-35 428 binding to Dopamine transporter (DAT)				J Med Chem 45: 654-62 (2002) BindingDB Entry DOI: 10.7270/Q2FJ2HHV
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50098393 (4-[4-(2-Benzhydryloxy-ethyl)-piperidin-1-ylmethyl]...) Show SMILES N#Cc1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C28H30N2O/c29-21-24-11-13-25(14-12-24)22-30-18-15-23(16-19-30)17-20-31-28(26-7-3-1-4-8-26)27-9-5-2-6-10-27/h1-14,23,28H,15-20,22H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	3.67	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description In vitro binding affinity at dopamine transporter in rat striatum by [3H]WIN-35428 displacement.				J Med Chem 44: 937-48 (2001) BindingDB Entry DOI: 10.7270/Q20002SR
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50108817 (4-(2-Benzhydryloxy-ethyl)-1-(4-ethynyl-benzyl)-pip...) Show SMILES C#Cc1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C29H31NO/c1-2-24-13-15-26(16-14-24)23-30-20-17-25(18-21-30)19-22-31-29(27-9-5-3-6-10-27)28-11-7-4-8-12-28/h1,3-16,25,29H,17-23H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.10	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Inhibition of 3[H] WIN-35 428 binding to Dopamine transporter (DAT)				J Med Chem 45: 654-62 (2002) BindingDB Entry DOI: 10.7270/Q2FJ2HHV
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50098396 (Benzhydryl-[2-(1-benzyl-piperidin-4-yl)-ethyl]-ami...) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)NC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C27H32N2/c1-4-10-24(11-5-1)22-29-20-17-23(18-21-29)16-19-28-27(25-12-6-2-7-13-25)26-14-8-3-9-15-26/h1-15,23,27-28H,16-22H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	4.5	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description In vitro binding affinity at dopamine transporter in rat striatum by [3H]WIN-35428 displacement.				J Med Chem 44: 937-48 (2001) BindingDB Entry DOI: 10.7270/Q20002SR
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50098396 (Benzhydryl-[2-(1-benzyl-piperidin-4-yl)-ethyl]-ami...) Show SMILES C(CC1CCN(Cc2ccccc2)CC1)NC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C27H32N2/c1-4-10-24(11-5-1)22-29-20-17-23(18-21-29)16-19-28-27(25-12-6-2-7-13-25)26-14-8-3-9-15-26/h1-15,23,27-28H,16-22H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	4.5	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Inhibition of 3[H] WIN-35 428 binding to Dopamine transporter (DAT)				J Med Chem 45: 654-62 (2002) BindingDB Entry DOI: 10.7270/Q2FJ2HHV
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50098395 (Benzhydryl-{2-[1-(3,4-difluoro-benzyl)-piperidin-4...) Show SMILES Fc1ccc(CN2CCC(CCNC(c3ccccc3)c3ccccc3)CC2)cc1F Show InChI InChI=1S/C27H30F2N2/c28-25-12-11-22(19-26(25)29)20-31-17-14-21(15-18-31)13-16-30-27(23-7-3-1-4-8-23)24-9-5-2-6-10-24/h1-12,19,21,27,30H,13-18,20H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description In vitro binding affinity at dopamine transporter in rat striatum by [3H]WIN-35428 displacement.				J Med Chem 44: 937-48 (2001) BindingDB Entry DOI: 10.7270/Q20002SR
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50108823 (4-[4-(2-Benzhydryloxy-ethyl)-piperidin-1-ylmethyl]...) Show SMILES COC(=O)c1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C29H33NO3/c1-32-29(31)27-14-12-24(13-15-27)22-30-19-16-23(17-20-30)18-21-33-28(25-8-4-2-5-9-25)26-10-6-3-7-11-26/h2-15,23,28H,16-22H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.23	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Inhibition of 3[H] WIN-35 428 binding to Dopamine transporter (DAT)				J Med Chem 45: 654-62 (2002) BindingDB Entry DOI: 10.7270/Q2FJ2HHV
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50066414 (Benzhydryl-{2-[1-(4-fluoro-benzyl)-piperidin-4-yl]...) Show SMILES Fc1ccc(CN2CCC(CCNC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C27H31FN2/c28-26-13-11-23(12-14-26)21-30-19-16-22(17-20-30)15-18-29-27(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,22,27,29H,15-21H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	9.37	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description In vitro binding affinity at dopamine transporter in rat striatum by [3H]WIN-35428 displacement.				J Med Chem 44: 937-48 (2001) BindingDB Entry DOI: 10.7270/Q20002SR
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50098397 (4-(2-Benzhydryloxy-ethyl)-1-(3,4-difluoro-benzyl)-...) Show SMILES Fc1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1F Show InChI InChI=1S/C27H29F2NO/c28-25-12-11-22(19-26(25)29)20-30-16-13-21(14-17-30)15-18-31-27(23-7-3-1-4-8-23)24-9-5-2-6-10-24/h1-12,19,21,27H,13-18,20H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	10.1	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description In vitro binding affinity at dopamine transporter in rat striatum by [3H]WIN-35428 displacement.				J Med Chem 44: 937-48 (2001) BindingDB Entry DOI: 10.7270/Q20002SR
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM22165 (1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(3-pheny...) Show SMILES Fc1ccc(cc1)C(OCCN1CCN(CCCc2ccccc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C28H32F2N2O/c29-26-12-8-24(9-13-26)28(25-10-14-27(30)15-11-25)33-22-21-32-19-17-31(18-20-32)16-4-7-23-5-2-1-3-6-23/h1-3,5-6,8-15,28H,4,7,16-22H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	10.6	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Inhibition of binding of 3[H] WIN-35 428 to Dopamine transporter (DAT) of rat striatum.				J Med Chem 45: 654-62 (2002) BindingDB Entry DOI: 10.7270/Q2FJ2HHV
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM22165 (1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(3-pheny...) Show SMILES Fc1ccc(cc1)C(OCCN1CCN(CCCc2ccccc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C28H32F2N2O/c29-26-12-8-24(9-13-26)28(25-10-14-27(30)15-11-25)33-22-21-32-19-17-31(18-20-32)16-4-7-23-5-2-1-3-6-23/h1-3,5-6,8-15,28H,4,7,16-22H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	10.6	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description In vitro binding affinity at dopamine transporter in rat striatum by [3H]WIN-35428 displacement.				J Med Chem 44: 937-48 (2001) BindingDB Entry DOI: 10.7270/Q20002SR
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50108820 (4-(2-Benzhydryloxy-ethyl)-1-(4-isopropenyl-benzyl)...) Show SMILES CC(=C)c1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C30H35NO/c1-24(2)27-15-13-26(14-16-27)23-31-20-17-25(18-21-31)19-22-32-30(28-9-5-3-6-10-28)29-11-7-4-8-12-29/h3-16,25,30H,1,17-23H2,2H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	11.6	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Inhibition of 3[H] WIN-35 428 binding to Dopamine transporter (DAT)				J Med Chem 45: 654-62 (2002) BindingDB Entry DOI: 10.7270/Q2FJ2HHV
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50108821 (3-[4-(2-Benzhydryloxy-ethyl)-piperidin-1-ylmethyl]...) Show SMILES Oc1cccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)c1 Show InChI InChI=1S/C27H31NO2/c29-26-13-7-8-23(20-26)21-28-17-14-22(15-18-28)16-19-30-27(24-9-3-1-4-10-24)25-11-5-2-6-12-25/h1-13,20,22,27,29H,14-19,21H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	14.3	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Inhibition of 3[H] WIN-35 428 binding to Dopamine transporter (DAT)				J Med Chem 45: 654-62 (2002) BindingDB Entry DOI: 10.7270/Q2FJ2HHV
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50055876 (4-(2-Benzhydryloxy-ethyl)-1-(4-fluoro-benzyl)-pipe...) Show SMILES Fc1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C27H30FNO/c28-26-13-11-23(12-14-26)21-29-18-15-22(16-19-29)17-20-30-27(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,22,27H,15-21H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	17.2	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description In vitro binding affinity at dopamine transporter in rat striatum by [3H]WIN-35428 displacement.				J Med Chem 44: 937-48 (2001) BindingDB Entry DOI: 10.7270/Q20002SR
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50108824 (4-(2-Benzhydryloxy-ethyl)-1-(3-methoxy-benzyl)-pip...) Show SMILES COc1cccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)c1 Show InChI InChI=1S/C28H33NO2/c1-30-27-14-8-9-24(21-27)22-29-18-15-23(16-19-29)17-20-31-28(25-10-4-2-5-11-25)26-12-6-3-7-13-26/h2-14,21,23,28H,15-20,22H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	19.6	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Inhibition of 3[H] WIN-35 428 binding to Dopamine transporter (DAT)				J Med Chem 45: 654-62 (2002) BindingDB Entry DOI: 10.7270/Q2FJ2HHV
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50098392 ((2,2-Diphenyl-ethyl)-[1-(4-fluoro-benzyl)-piperidi...) Show SMILES Fc1ccc(CN2CCC(CNCC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C27H31FN2/c28-26-13-11-23(12-14-26)21-30-17-15-22(16-18-30)19-29-20-27(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,22,27,29H,15-21H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	19.7	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description In vitro binding affinity at dopamine transporter in rat striatum by [3H]WIN-35428 displacement.				J Med Chem 44: 937-48 (2001) BindingDB Entry DOI: 10.7270/Q20002SR
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50098399 (4-(2-Benzhydryloxy-ethyl)-1-(3-fluoro-benzyl)-pipe...) Show SMILES Fc1cccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)c1 Show InChI InChI=1S/C27H30FNO/c28-26-13-7-8-23(20-26)21-29-17-14-22(15-18-29)16-19-30-27(24-9-3-1-4-10-24)25-11-5-2-6-12-25/h1-13,20,22,27H,14-19,21H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	23.4	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description In vitro binding affinity at dopamine transporter in rat striatum by [3H]WIN-35428 displacement.				J Med Chem 44: 937-48 (2001) BindingDB Entry DOI: 10.7270/Q20002SR
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50098394 (CHEMBL353643 | N-{4-[4-(2-Benzhydryloxy-ethyl)-pip...) Show SMILES CS(=O)(=O)Nc1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C28H34N2O3S/c1-34(31,32)29-27-14-12-24(13-15-27)22-30-19-16-23(17-20-30)18-21-33-28(25-8-4-2-5-9-25)26-10-6-3-7-11-26/h2-15,23,28-29H,16-22H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	26.6	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description In vitro binding affinity at dopamine transporter in rat striatum by [3H]WIN-35428 displacement.				J Med Chem 44: 937-48 (2001) BindingDB Entry DOI: 10.7270/Q20002SR
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50108819 (4-(2-Benzhydryloxy-ethyl)-1-(4-naphthalen-2-yl-ben...) Show SMILES C(CC1CCN(Cc2ccc(cc2)-c2ccc3ccccc3c2)CC1)OC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C37H37NO/c1-3-10-33(11-4-1)37(34-12-5-2-6-13-34)39-26-23-29-21-24-38(25-22-29)28-30-15-17-32(18-16-30)36-20-19-31-9-7-8-14-35(31)27-36/h1-20,27,29,37H,21-26,28H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	26.9	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Inhibition of 3[H] WIN-35 428 binding to Dopamine transporter (DAT)				J Med Chem 45: 654-62 (2002) BindingDB Entry DOI: 10.7270/Q2FJ2HHV
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50098405 (4-(2-Benzhydryloxy-ethyl)-1-(4-trifluoromethyl-ben...) Show SMILES FC(F)(F)c1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C28H30F3NO/c29-28(30,31)26-13-11-23(12-14-26)21-32-18-15-22(16-19-32)17-20-33-27(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,22,27H,15-21H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	32.1	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description In vitro binding affinity at dopamine transporter in rat striatum by [3H]WIN-35428 displacement.				J Med Chem 44: 937-48 (2001) BindingDB Entry DOI: 10.7270/Q20002SR
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50098404 (CHEMBL424005 | O-Benzhydryl-N-[1-(4-fluoro-benzyl)...) Show SMILES Fc1ccc(CN2CCC(CNOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C26H29FN2O/c27-25-13-11-22(12-14-25)20-29-17-15-21(16-18-29)19-28-30-26(23-7-3-1-4-8-23)24-9-5-2-6-10-24/h1-14,21,26,28H,15-20H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	34.4	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description In vitro binding affinity at dopamine transporter in rat striatum by [3H]WIN-35428 displacement.				J Med Chem 44: 937-48 (2001) BindingDB Entry DOI: 10.7270/Q20002SR
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50108816 (3-(2-Benzhydryloxy-ethyl)-1-(4-isopropyl-benzyl)-p...) Show SMILES CC(C)c1ccc(CN2CCCC(CCOC(c3ccccc3)c3ccccc3)C2)cc1 Show InChI InChI=1S/C30H37NO/c1-24(2)27-17-15-26(16-18-27)23-31-20-9-10-25(22-31)19-21-32-30(28-11-5-3-6-12-28)29-13-7-4-8-14-29/h3-8,11-18,24-25,30H,9-10,19-23H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	63.1	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Inhibition of 3[H] WIN-35 428 binding to Dopamine transporter (DAT)				J Med Chem 45: 654-62 (2002) BindingDB Entry DOI: 10.7270/Q2FJ2HHV
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50108822 (4-(2-Benzhydryloxy-ethyl)-1-(4-prop-1-ynyl-benzyl)...) Show SMILES CC#Cc1ccc(CN2CCC(CCOC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C30H33NO/c1-2-9-25-14-16-27(17-15-25)24-31-21-18-26(19-22-31)20-23-32-30(28-10-5-3-6-11-28)29-12-7-4-8-13-29/h3-8,10-17,26,30H,18-24H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	65.1	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Inhibition of 3[H] WIN-35 428 binding to Dopamine transporter (DAT)				J Med Chem 45: 654-62 (2002) BindingDB Entry DOI: 10.7270/Q2FJ2HHV
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50098402 (CHEMBL173812 | [Bis-(4-fluoro-phenyl)-methyl]-(1-p...) Show SMILES Fc1ccc(cc1)C(NCC1CCN(CCc2ccccc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C27H30F2N2/c28-25-10-6-23(7-11-25)27(24-8-12-26(29)13-9-24)30-20-22-15-18-31(19-16-22)17-14-21-4-2-1-3-5-21/h1-13,22,27,30H,14-20H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	65.3	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description In vitro binding affinity at dopamine transporter in rat striatum by [3H]WIN-35428 displacement.				J Med Chem 44: 937-48 (2001) BindingDB Entry DOI: 10.7270/Q20002SR
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50098401 ((2,2-Diphenyl-ethyl)-[1-(4-fluoro-benzyl)-piperidi...) Show SMILES CN(CC(c1ccccc1)c1ccccc1)CC1CCN(Cc2ccc(F)cc2)CC1 Show InChI InChI=1S/C28H33FN2/c1-30(22-28(25-8-4-2-5-9-25)26-10-6-3-7-11-26)20-24-16-18-31(19-17-24)21-23-12-14-27(29)15-13-23/h2-15,24,28H,16-22H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	94	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description In vitro binding affinity at dopamine transporter in rat striatum by [3H]WIN-35428 displacement.				J Med Chem 44: 937-48 (2001) BindingDB Entry DOI: 10.7270/Q20002SR
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50108825 (4-(2-Benzhydryloxy-ethyl)-1-(4-naphthalen-1-yl-ben...) Show SMILES C(CC1CCN(Cc2ccc(cc2)-c2cccc3ccccc23)CC1)OC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C37H37NO/c1-3-11-33(12-4-1)37(34-13-5-2-6-14-34)39-27-24-29-22-25-38(26-23-29)28-30-18-20-32(21-19-30)36-17-9-15-31-10-7-8-16-35(31)36/h1-21,29,37H,22-28H2	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	113	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Inhibition of 3[H] WIN-35 428 binding to Dopamine transporter (DAT)				J Med Chem 45: 654-62 (2002) BindingDB Entry DOI: 10.7270/Q2FJ2HHV
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM22165 (1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(3-pheny...) Show SMILES Fc1ccc(cc1)C(OCCN1CCN(CCCc2ccccc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C28H32F2N2O/c29-26-12-8-24(9-13-26)28(25-10-14-27(30)15-11-25)33-22-21-32-19-17-31(18-20-32)16-4-7-23-5-2-1-3-6-23/h1-3,5-6,8-15,28H,4,7,16-22H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	132	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description In vitro binding affinity at serotonin transporter in rat striatum by [3H]- citalopram displacement.				J Med Chem 44: 937-48 (2001) BindingDB Entry DOI: 10.7270/Q20002SR
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM22165 (1-{2-[bis(4-fluorophenyl)methoxy]ethyl}-4-(3-pheny...) Show SMILES Fc1ccc(cc1)C(OCCN1CCN(CCCc2ccccc2)CC1)c1ccc(F)cc1 Show InChI InChI=1S/C28H32F2N2O/c29-26-12-8-24(9-13-26)28(25-10-14-27(30)15-11-25)33-22-21-32-19-17-31(18-20-32)16-4-7-23-5-2-1-3-6-23/h1-3,5-6,8-15,28H,4,7,16-22H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	132	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description Inhibition of binding of [3H]- citalopram to Serotonin transporter (SERT) of rat cerebral cortex.				J Med Chem 45: 654-62 (2002) BindingDB Entry DOI: 10.7270/Q2FJ2HHV
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50098392 ((2,2-Diphenyl-ethyl)-[1-(4-fluoro-benzyl)-piperidi...) Show SMILES Fc1ccc(CN2CCC(CNCC(c3ccccc3)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C27H31FN2/c28-26-13-11-23(12-14-26)21-30-17-15-22(16-18-30)19-29-20-27(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,22,27,29H,15-21H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	137	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University Curated by ChEMBL					Assay Description In vitro binding affinity at serotonin transporter in rat striatum by [3H]- citalopram displacement.				J Med Chem 44: 937-48 (2001) BindingDB Entry DOI: 10.7270/Q20002SR
					More data for this Ligand-Target Pair

Displayed 1 to 50 (of 111 total )  |  Next  |  Last  >>

Jump to: