Compile Data Set for Download or QSAR

Found 21 hits with Last Name = 'holman' and Initial = 'bl'   

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 (Macaca fascicularis)	BDBM50058293 (3-(4-Fluoro-phenyl)-8-(3-phenyl-propyl)-8-aza-bicy...) Show SMILES COC(=O)C1C2CCC(CC1c1ccc(F)cc1)N2CCCc1ccccc1 |TLB:19:18:4.10.9:6.7,THB:2:4:18:6.7,11:10:18:6.7| Show InChI InChI=1S/C24H28FNO2/c1-28-24(27)23-21(18-9-11-19(25)12-10-18)16-20-13-14-22(23)26(20)15-5-8-17-6-3-2-4-7-17/h2-4,6-7,9-12,20-23H,5,8,13-16H2,1H3	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]WIN35,428 binding to dopamine transporter using of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Macaca fascicularis)	BDBM50058287 (3-(4-Fluoro-phenyl)-8-(5-phenyl-pentyl)-8-aza-bicy...) Show SMILES COC(=O)C1C2CCC(CC1c1ccc(F)cc1)N2CCCCCc1ccccc1 |TLB:19:18:4.10.9:6.7,THB:2:4:18:6.7,11:10:18:6.7| Show InChI InChI=1S/C26H32FNO2/c1-30-26(29)25-23(20-11-13-21(27)14-12-20)18-22-15-16-24(25)28(22)17-7-3-6-10-19-8-4-2-5-9-19/h2,4-5,8-9,11-14,22-25H,3,6-7,10,15-18H2,1H3	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.40	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]WIN35,428 binding to dopamine transporter using of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Macaca fascicularis)	BDBM50058286 ((1R,12R) | (1R,12S) | CHEMBL119561 | Diastereiosom...) Show SMILES COC(=O)C1C2CCC(CC1c1ccc(F)cc1)N2CCCN1CCS[Re]2(=O)SCCN2C(=O)C1 |TLB:19:18:4.10.9:6.7,THB:11:10:18:6.7,2:4:18:6.7| Show InChI InChI=1S/C24H36FN3O3S2.O.Re/c1-31-24(30)23-20(17-3-5-18(25)6-4-17)15-19-7-8-21(23)28(19)11-2-10-27(12-14-33)16-22(29)26-9-13-32;;/h3-6,19-21,23H,2,7-16H2,1H3,(H3,26,29,32,33);;/q;;+4/p-3	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC sid UniChem Similars	Article PubMed	n/a	n/a	7.38	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]WIN35,428 binding to dopamine transporter using of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50058294 ((2R,3S)-3-[Bis-(4-fluoro-phenyl)-methoxy]-8-(3-phe...) Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(c1ccc(F)cc1)c1ccc(F)cc1)N2CCCc1ccccc1 |TLB:28:27:4.10.9:6.7,11:10:27:6.7,THB:2:4:27:6.7| Show InChI InChI=1S/C31H33F2NO3/c1-36-31(35)29-27-18-17-26(34(27)19-5-8-21-6-3-2-4-7-21)20-28(29)37-30(22-9-13-24(32)14-10-22)23-11-15-25(33)16-12-23/h2-4,6-7,9-16,26-30H,5,8,17-20H2,1H3/t26?,27?,28-,29+/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	19.7	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]- citalopram binding to serotonin transporter of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Macaca fascicularis)	BDBM50058294 ((2R,3S)-3-[Bis-(4-fluoro-phenyl)-methoxy]-8-(3-phe...) Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(c1ccc(F)cc1)c1ccc(F)cc1)N2CCCc1ccccc1 |TLB:28:27:4.10.9:6.7,11:10:27:6.7,THB:2:4:27:6.7| Show InChI InChI=1S/C31H33F2NO3/c1-36-31(35)29-27-18-17-26(34(27)19-5-8-21-6-3-2-4-7-21)20-28(29)37-30(22-9-13-24(32)14-10-22)23-11-15-25(33)16-12-23/h2-4,6-7,9-16,26-30H,5,8,17-20H2,1H3/t26?,27?,28-,29+/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]WIN35,428 binding to dopamine transporter using of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Macaca fascicularis)	BDBM50058292 (CHEMBL118075 | O-1196 | O-863 | [N-[2-[(3'-N'-Prop...) Show SMILES COC(=O)C1C2CCC(CC1c1ccc(Cl)c(Cl)c1)N2CCC[N+]12CCS[Re]11(=O)SCCN1C(=O)C2 |TLB:11:10:19:6.7,20:19:4.10.9:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C24H35Cl2N3O3S2.O.Re/c1-32-24(31)23-18(16-3-5-19(25)20(26)13-16)14-17-4-6-21(23)29(17)9-2-8-28(10-12-34)15-22(30)27-7-11-33;;/h3,5,13,17-18,21,23H,2,4,6-12,14-15H2,1H3,(H3,27,30,33,34);;/q;;+4/p-3	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC sid UniChem Similars	Article PubMed	n/a	n/a	37.2	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]WIN35,428 binding to dopamine transporter using of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50058287 (3-(4-Fluoro-phenyl)-8-(5-phenyl-pentyl)-8-aza-bicy...) Show SMILES COC(=O)C1C2CCC(CC1c1ccc(F)cc1)N2CCCCCc1ccccc1 |TLB:19:18:4.10.9:6.7,THB:2:4:18:6.7,11:10:18:6.7| Show InChI InChI=1S/C26H32FNO2/c1-30-26(29)25-23(20-11-13-21(27)14-12-20)18-22-15-16-24(25)28(22)17-7-3-6-10-19-8-4-2-5-9-19/h2,4-5,8-9,11-14,22-25H,3,6-7,10,15-18H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	49.9	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]- citalopram binding to serotonin transporter of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Macaca fascicularis)	BDBM50058295 (8-Benzyl-3-(4-fluoro-phenyl)-8-aza-bicyclo[3.2.1]o...) Show SMILES COC(=O)C1C2CCC(CC1c1ccc(F)cc1)N2Cc1ccccc1 |TLB:19:18:4.10.9:6.7,THB:2:4:18:6.7,11:10:18:6.7| Show InChI InChI=1S/C22H24FNO2/c1-26-22(25)21-19(16-7-9-17(23)10-8-16)13-18-11-12-20(21)24(18)14-15-5-3-2-4-6-15/h2-10,18-21H,11-14H2,1H3	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	58.9	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]WIN35,428 binding to dopamine transporter using of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Macaca fascicularis)	BDBM50058289 ((2R,3S)-3-[Bis-(4-fluoro-phenyl)-methoxy]-8-(5-phe...) Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(c1ccc(F)cc1)c1ccc(F)cc1)N2CCCCCc1ccccc1 |TLB:28:27:4.10.9:6.7,11:10:27:6.7,THB:2:4:27:6.7| Show InChI InChI=1S/C33H37F2NO3/c1-38-33(37)31-29-20-19-28(36(29)21-7-3-6-10-23-8-4-2-5-9-23)22-30(31)39-32(24-11-15-26(34)16-12-24)25-13-17-27(35)18-14-25/h2,4-5,8-9,11-18,28-32H,3,6-7,10,19-22H2,1H3/t28?,29?,30-,31+/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	99	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]WIN35,428 binding to dopamine transporter using of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50058286 ((1R,12R) | (1R,12S) | CHEMBL119561 | Diastereiosom...) Show SMILES COC(=O)C1C2CCC(CC1c1ccc(F)cc1)N2CCCN1CCS[Re]2(=O)SCCN2C(=O)C1 |TLB:19:18:4.10.9:6.7,THB:11:10:18:6.7,2:4:18:6.7| Show InChI InChI=1S/C24H36FN3O3S2.O.Re/c1-31-24(30)23-20(17-3-5-18(25)6-4-17)15-19-7-8-21(23)28(19)11-2-10-27(12-14-33)16-22(29)26-9-13-32;;/h3-6,19-21,23H,2,7-16H2,1H3,(H3,26,29,32,33);;/q;;+4/p-3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC sid UniChem Similars	Article PubMed	n/a	n/a	124	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]- citalopram binding to serotonin transporter of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50058293 (3-(4-Fluoro-phenyl)-8-(3-phenyl-propyl)-8-aza-bicy...) Show SMILES COC(=O)C1C2CCC(CC1c1ccc(F)cc1)N2CCCc1ccccc1 |TLB:19:18:4.10.9:6.7,THB:2:4:18:6.7,11:10:18:6.7| Show InChI InChI=1S/C24H28FNO2/c1-28-24(27)23-21(18-9-11-19(25)12-10-18)16-20-13-14-22(23)26(20)15-5-8-17-6-3-2-4-7-17/h2-4,6-7,9-12,20-23H,5,8,13-16H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	133	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]- citalopram binding to serotonin transporter of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Macaca fascicularis)	BDBM50058290 ((2R,3S)-8-Benzyl-3-[bis-(4-fluoro-phenyl)-methoxy]...) Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(c1ccc(F)cc1)c1ccc(F)cc1)N2Cc1ccccc1 |TLB:11:10:27:6.7,28:27:4.10.9:6.7,THB:2:4:27:6.7| Show InChI InChI=1S/C29H29F2NO3/c1-34-29(33)27-25-16-15-24(32(25)18-19-5-3-2-4-6-19)17-26(27)35-28(20-7-11-22(30)12-8-20)21-9-13-23(31)14-10-21/h2-14,24-28H,15-18H2,1H3/t24?,25?,26-,27+/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	223	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]WIN35,428 binding to dopamine transporter using of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50058292 (CHEMBL118075 | O-1196 | O-863 | [N-[2-[(3'-N'-Prop...) Show SMILES COC(=O)C1C2CCC(CC1c1ccc(Cl)c(Cl)c1)N2CCC[N+]12CCS[Re]11(=O)SCCN1C(=O)C2 |TLB:11:10:19:6.7,20:19:4.10.9:6.7,THB:2:4:19:6.7| Show InChI InChI=1S/C24H35Cl2N3O3S2.O.Re/c1-32-24(31)23-18(16-3-5-19(25)20(26)13-16)14-17-4-6-21(23)29(17)9-2-8-28(10-12-34)15-22(30)27-7-11-33;;/h3,5,13,17-18,21,23H,2,4,6-12,14-15H2,1H3,(H3,27,30,33,34);;/q;;+4/p-3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC sid UniChem Similars	Article PubMed	n/a	n/a	264	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]- citalopram binding to serotonin transporter of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Macaca fascicularis)	BDBM50279764 (CHEMBL55730 | Diastereiosomer of[N-[2-[(3'-N'-Prop...) Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(c1ccc(F)cc1)c1ccc(F)cc1)N2CCCN1CCS[Re]2(=O)SCCN2C(=O)C1 |TLB:28:27:4.10.9:6.7,11:10:27:6.7,THB:2:4:27:6.7| Show InChI InChI=1S/C31H41F2N3O4S2.O.Re/c1-39-31(38)29-26-12-11-25(36(26)15-2-14-35(16-18-42)20-28(37)34-13-17-41)19-27(29)40-30(21-3-7-23(32)8-4-21)22-5-9-24(33)10-6-22;;/h3-10,25-27,29-30H,2,11-20H2,1H3,(H3,34,37,41,42);;/q;;+4/p-3/t25?,26?,27-,29+;;/m0../s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC sid UniChem Similars	Article PubMed	n/a	n/a	343	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]WIN35,428 binding to dopamine transporter using of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Macaca fascicularis)	BDBM50279764 (CHEMBL55730 | Diastereiosomer of[N-[2-[(3'-N'-Prop...) Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(c1ccc(F)cc1)c1ccc(F)cc1)N2CCCN1CCS[Re]2(=O)SCCN2C(=O)C1 |TLB:28:27:4.10.9:6.7,11:10:27:6.7,THB:2:4:27:6.7| Show InChI InChI=1S/C31H41F2N3O4S2.O.Re/c1-39-31(38)29-26-12-11-25(36(26)15-2-14-35(16-18-42)20-28(37)34-13-17-41)19-27(29)40-30(21-3-7-23(32)8-4-21)22-5-9-24(33)10-6-22;;/h3-10,25-27,29-30H,2,11-20H2,1H3,(H3,34,37,41,42);;/q;;+4/p-3/t25?,26?,27-,29+;;/m0../s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC sid UniChem Similars	Article PubMed	n/a	n/a	343	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]WIN35,428 binding to dopamine transporter using of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50058289 ((2R,3S)-3-[Bis-(4-fluoro-phenyl)-methoxy]-8-(5-phe...) Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(c1ccc(F)cc1)c1ccc(F)cc1)N2CCCCCc1ccccc1 |TLB:28:27:4.10.9:6.7,11:10:27:6.7,THB:2:4:27:6.7| Show InChI InChI=1S/C33H37F2NO3/c1-38-33(37)31-29-20-19-28(36(29)21-7-3-6-10-23-8-4-2-5-9-23)22-30(31)39-32(24-11-15-26(34)16-12-24)25-13-17-27(35)18-14-25/h2,4-5,8-9,11-18,28-32H,3,6-7,10,19-22H2,1H3/t28?,29?,30-,31+/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]- citalopram binding to serotonin transporter of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50058295 (8-Benzyl-3-(4-fluoro-phenyl)-8-aza-bicyclo[3.2.1]o...) Show SMILES COC(=O)C1C2CCC(CC1c1ccc(F)cc1)N2Cc1ccccc1 |TLB:19:18:4.10.9:6.7,THB:2:4:18:6.7,11:10:18:6.7| Show InChI InChI=1S/C22H24FNO2/c1-26-22(25)21-19(16-7-9-17(23)10-8-16)13-18-11-12-20(21)24(18)14-15-5-3-2-4-6-15/h2-10,18-21H,11-14H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.07E+3	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]- citalopram binding to serotonin transporter of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Macaca fascicularis)	BDBM50058286 ((1R,12R) | (1R,12S) | CHEMBL119561 | Diastereiosom...) Show SMILES COC(=O)C1C2CCC(CC1c1ccc(F)cc1)N2CCCN1CCS[Re]2(=O)SCCN2C(=O)C1 |TLB:19:18:4.10.9:6.7,THB:11:10:18:6.7,2:4:18:6.7| Show InChI InChI=1S/C24H36FN3O3S2.O.Re/c1-31-24(30)23-20(17-3-5-18(25)6-4-17)15-19-7-8-21(23)28(19)11-2-10-27(12-14-33)16-22(29)26-9-13-32;;/h3-6,19-21,23H,2,7-16H2,1H3,(H3,26,29,32,33);;/q;;+4/p-3	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC sid UniChem Similars	Article PubMed	n/a	n/a	2.96E+3	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]WIN35,428 binding to dopamine transporter using of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50058290 ((2R,3S)-8-Benzyl-3-[bis-(4-fluoro-phenyl)-methoxy]...) Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(c1ccc(F)cc1)c1ccc(F)cc1)N2Cc1ccccc1 |TLB:11:10:27:6.7,28:27:4.10.9:6.7,THB:2:4:27:6.7| Show InChI InChI=1S/C29H29F2NO3/c1-34-29(33)27-25-16-15-24(32(25)18-19-5-3-2-4-6-19)17-26(27)35-28(20-7-11-22(30)12-8-20)21-9-13-23(31)14-10-21/h2-14,24-28H,15-18H2,1H3/t24?,25?,26-,27+/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.97E+3	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]- citalopram binding to serotonin transporter of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50058286 ((1R,12R) | (1R,12S) | CHEMBL119561 | Diastereiosom...) Show SMILES COC(=O)C1C2CCC(CC1c1ccc(F)cc1)N2CCCN1CCS[Re]2(=O)SCCN2C(=O)C1 |TLB:19:18:4.10.9:6.7,THB:11:10:18:6.7,2:4:18:6.7| Show InChI InChI=1S/C24H36FN3O3S2.O.Re/c1-31-24(30)23-20(17-3-5-18(25)6-4-17)15-19-7-8-21(23)28(19)11-2-10-27(12-14-33)16-22(29)26-9-13-32;;/h3-6,19-21,23H,2,7-16H2,1H3,(H3,26,29,32,33);;/q;;+4/p-3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC sid UniChem Similars	Article PubMed	n/a	n/a	5.02E+3	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]- citalopram binding to serotonin transporter of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50279764 (CHEMBL55730 | Diastereiosomer of[N-[2-[(3'-N'-Prop...) Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1OC(c1ccc(F)cc1)c1ccc(F)cc1)N2CCCN1CCS[Re]2(=O)SCCN2C(=O)C1 |TLB:28:27:4.10.9:6.7,11:10:27:6.7,THB:2:4:27:6.7| Show InChI InChI=1S/C31H41F2N3O4S2.O.Re/c1-39-31(38)29-26-12-11-25(36(26)15-2-14-35(16-18-42)20-28(37)34-13-17-41)19-27(29)40-30(21-3-7-23(32)8-4-21)22-5-9-24(33)10-6-22;;/h3-10,25-27,29-30H,2,11-20H2,1H3,(H3,34,37,41,42);;/q;;+4/p-3/t25?,26?,27-,29+;;/m0../s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC sid UniChem Similars	Article PubMed	n/a	n/a	5.52E+4	n/a	n/a	n/a	n/a	n/a	n/a
Organix Inc. Curated by ChEMBL					Assay Description Inhibition of [3H]- citalopram binding to serotonin transporter of Cynomolgus monkey caudate-putamen				J Med Chem 40: 1835-44 (1997) Article DOI: 10.1021/jm960868t BindingDB Entry DOI: 10.7270/Q2125RSX
					More data for this Ligand-Target Pair