Compile Data Set for Download or QSAR

Found 181 hits with Last Name = 'mukhopadhyaya' and Initial = 'j'   

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 serotonin transporter (Rattus norvegicus (rat))	BDBM50111036 (Benzoic acid 9-(3-chloro-4-iodo-benzylidene)-7-aza...) Show SMILES Clc1cc(\C=C2/CN3C4CCC3C(COC(=O)c3ccccc3)C2C4)ccc1I |TLB:13:12:5.6:8.24,THB:10:11:5.6:8.24| Show InChI InChI=1S/C24H23ClINO2/c25-21-11-15(6-8-22(21)26)10-17-13-27-18-7-9-23(27)20(19(17)12-18)14-29-24(28)16-4-2-1-3-5-16/h1-6,8,10-11,18-20,23H,7,9,12-14H2/b17-10+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.0600	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50111035 (Benzoic acid 9-(4-iodo-benzylidene)-7-aza-tricyclo...) Show SMILES Ic1ccc(\C=C2/CN3C4CCC3C(COC(=O)c3ccccc3)C2C4)cc1 |TLB:14:13:6.7:9.25,THB:11:12:6.7:9.25| Show InChI InChI=1S/C24H24INO2/c25-19-8-6-16(7-9-19)12-18-14-26-20-10-11-23(26)22(21(18)13-20)15-28-24(27)17-4-2-1-3-5-17/h1-9,12,20-23H,10-11,13-15H2/b18-12+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112273 (Benzoic acid 9-naphthalen-2-ylmethylene-7-aza-tric...) Show SMILES O=C(OCC1C2CCC3CC1\C(CN23)=C\c1ccc2ccccc2c1)c1ccccc1 |TLB:6:5:11.12:8.9,THB:3:4:11.12:8.9| Show InChI InChI=1S/C28H27NO2/c30-28(21-7-2-1-3-8-21)31-18-26-25-16-24-12-13-27(26)29(24)17-23(25)15-19-10-11-20-6-4-5-9-22(20)14-19/h1-11,14-15,24-27H,12-13,16-18H2/b23-15+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112307 (Acetic acid 9-(3,4-dichloro-benzylidene)-7-aza-tri...) Show SMILES CC(=O)OCC1C2CCC3CC1\C(CN23)=C\c1ccc(Cl)c(Cl)c1 |TLB:7:6:12.13:9.10,THB:4:5:12.13:9.10| Show InChI InChI=1S/C19H21Cl2NO2/c1-11(23)24-10-16-15-8-14-3-5-19(16)22(14)9-13(15)6-12-2-4-17(20)18(21)7-12/h2,4,6-7,14-16,19H,3,5,8-10H2,1H3/b13-6+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112301 (9-(3-Chloro-4-iodo-benzylidene)-7-aza-tricyclo[4.3...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(I)c(Cl)c1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C18H19ClINO2/c1-23-18(22)17-13-8-12-3-5-16(17)21(12)9-11(13)6-10-2-4-15(20)14(19)7-10/h2,4,6-7,12-13,16-17H,3,5,8-9H2,1H3/b11-6+	PDB KEGG UniProtKB/SwissProt 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
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112305 (Benzoic acid 9-(3-chloro-4-methyl-benzylidene)-7-a...) Show SMILES Cc1ccc(\C=C2/CN3C4CCC3C(COC(=O)c3ccccc3)C2C4)cc1Cl |TLB:14:13:6.7:9.25,THB:11:12:6.7:9.25| Show InChI InChI=1S/C25H26ClNO2/c1-16-7-8-17(12-23(16)26)11-19-14-27-20-9-10-24(27)22(21(19)13-20)15-29-25(28)18-5-3-2-4-6-18/h2-8,11-12,20-22,24H,9-10,13-15H2,1H3/b19-11+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112276 (1-[9-(3,4-Dichloro-benzylidene)-7-aza-tricyclo[4.3...) Show SMILES CCC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(Cl)c(Cl)c1 |TLB:6:5:11.12:8.9,THB:2:4:11.12:8.9| Show InChI InChI=1S/C19H21Cl2NO/c1-2-18(23)19-14-9-13-4-6-17(19)22(13)10-12(14)7-11-3-5-15(20)16(21)8-11/h3,5,7-8,13-14,17,19H,2,4,6,9-10H2,1H3/b12-7+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112288 (9-(4-Bromo-3-chloro-benzylidene)-7-aza-tricyclo[4....) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(Br)c(Cl)c1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C18H19BrClNO2/c1-23-18(22)17-13-8-12-3-5-16(17)21(12)9-11(13)6-10-2-4-14(19)15(20)7-10/h2,4,6-7,12-13,16-17H,3,5,8-9H2,1H3/b11-6+	PDB KEGG UniProtKB/SwissProt 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
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112284 (Benzoic acid 9-(3,4-dichloro-benzylidene)-7-aza-tr...) Show SMILES Clc1ccc(\C=C2/CN3C4CCC3C(COC(=O)c3ccccc3)C2C4)cc1Cl |TLB:14:13:6.7:9.25,THB:11:12:6.7:9.25| Show InChI InChI=1S/C24H23Cl2NO2/c25-21-8-6-15(11-22(21)26)10-17-13-27-18-7-9-23(27)20(19(17)12-18)14-29-24(28)16-4-2-1-3-5-16/h1-6,8,10-11,18-20,23H,7,9,12-14H2/b17-10+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112297 (Benzoic acid 9-(4-bromo-3-chloro-benzylidene)-7-az...) Show SMILES Clc1cc(\C=C2/CN3C4CCC3C(COC(=O)c3ccccc3)C2C4)ccc1Br |TLB:13:12:5.6:8.24,THB:10:11:5.6:8.24| Show InChI InChI=1S/C24H23BrClNO2/c25-21-8-6-15(11-22(21)26)10-17-13-27-18-7-9-23(27)20(19(17)12-18)14-29-24(28)16-4-2-1-3-5-16/h1-6,8,10-11,18-20,23H,7,9,12-14H2/b17-10+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112295 (Benzoic acid 9-(4-bromo-benzylidene)-7-aza-tricycl...) Show SMILES Brc1ccc(\C=C2/CN3C4CCC3C(COC(=O)c3ccccc3)C2C4)cc1 |TLB:14:13:6.7:9.25,THB:11:12:6.7:9.25| Show InChI InChI=1S/C24H24BrNO2/c25-19-8-6-16(7-9-19)12-18-14-26-20-10-11-23(26)22(21(18)13-20)15-28-24(27)17-4-2-1-3-5-17/h1-9,12,20-23H,10-11,13-15H2/b18-12+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.95	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112274 (Acetic acid 9-naphthalen-2-ylmethylene-7-aza-tricy...) Show SMILES CC(=O)OCC1C2CCC3CC1\C(CN23)=C\c1ccc2ccccc2c1 |TLB:7:6:12.13:9.10,THB:4:5:12.13:9.10| Show InChI InChI=1S/C23H25NO2/c1-15(25)26-14-22-21-12-20-8-9-23(22)24(20)13-19(21)11-16-6-7-17-4-2-3-5-18(17)10-16/h2-7,10-11,20-23H,8-9,12-14H2,1H3/b19-11+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112293 (9-(3-Chloro-4-methyl-benzylidene)-7-aza-tricyclo[4...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(C)c(Cl)c1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C19H22ClNO2/c1-11-3-4-12(8-16(11)20)7-13-10-21-14-5-6-17(21)18(15(13)9-14)19(22)23-2/h3-4,7-8,14-15,17-18H,5-6,9-10H2,1-2H3/b13-7+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	6.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM30130 (CHEMBL1201082 | CHEMBL41 | Fluoxetin | Fluoxetine ...) Show SMILES CNCCC(Oc1ccc(cc1)C(F)(F)F)c1ccccc1 Show InChI InChI=1S/C17H18F3NO/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20/h2-10,16,21H,11-12H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	PubMed	7.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112289 (CHEMBL265808 | Undecanedioic acid bis-[9-(3,4-dich...) Show SMILES Clc1ccc(\C=C2/CN3C4CCC3C(COC(=O)CCCCCCCCCC(=O)OCC3C5CCC6CC3\C(CN56)=C\c3ccc(Cl)c(Cl)c3)C2C4)cc1Cl |TLB:14:13:6.7:9.51,33:32:38.39:35.36,THB:30:31:40:33.34,30:31:38.39:35.36,38:37:40:33.34,11:12:6.7:9.51,39:40:31.37.36:33.34| Show InChI InChI=1S/C45H54Cl4N2O4/c46-38-14-10-28(20-40(38)48)18-30-24-50-32-12-16-42(50)36(34(30)22-32)26-54-44(52)8-6-4-2-1-3-5-7-9-45(53)55-27-37-35-23-33-13-17-43(37)51(33)25-31(35)19-29-11-15-39(47)41(49)21-29/h10-11,14-15,18-21,32-37,42-43H,1-9,12-13,16-17,22-27H2/b30-18+,31-19+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	8.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112306 (CHEMBL58392 | Naphthalene-2-carboxylic acid 9-(3,4...) Show SMILES Clc1ccc(\C=C2/CN3C4CCC3C(COC(=O)c3ccc5ccccc5c3)C2C4)cc1Cl |TLB:14:13:6.7:9.29,THB:11:12:6.7:9.29| Show InChI InChI=1S/C28H25Cl2NO2/c29-25-9-5-17(12-26(25)30)11-21-15-31-22-8-10-27(31)24(23(21)14-22)16-33-28(32)20-7-6-18-3-1-2-4-19(18)13-20/h1-7,9,11-13,22-24,27H,8,10,14-16H2/b21-11+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	9.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112271 (9-(3,4-Dimethyl-benzylidene)-7-aza-tricyclo[4.3.1....) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(C)c(C)c1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C20H25NO2/c1-12-4-5-14(8-13(12)2)9-15-11-21-16-6-7-18(21)19(17(15)10-16)20(22)23-3/h4-5,8-9,16-19H,6-7,10-11H2,1-3H3/b15-9+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	10.1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112279 (9-(4-Isopropyl-benzylidene)-7-aza-tricyclo[4.3.1.0...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(cc1)C(C)C |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C21H27NO2/c1-13(2)15-6-4-14(5-7-15)10-16-12-22-17-8-9-19(22)20(18(16)11-17)21(23)24-3/h4-7,10,13,17-20H,8-9,11-12H2,1-3H3/b16-10+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	10.2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112270 (Benzoic acid 9-(3-chloro-benzylidene)-7-aza-tricyc...) Show SMILES Clc1cccc(\C=C2/CN3C4CCC3C(COC(=O)c3ccccc3)C2C4)c1 |TLB:15:14:7.8:10.26,THB:12:13:7.8:10.26| Show InChI InChI=1S/C24H24ClNO2/c25-19-8-4-5-16(12-19)11-18-14-26-20-9-10-23(26)22(21(18)13-20)15-28-24(27)17-6-2-1-3-7-17/h1-8,11-12,20-23H,9-10,13-15H2/b18-11+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112281 (9-(4-Bromo-benzylidene)-7-aza-tricyclo[4.3.1.0*3,7...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(Br)cc1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C18H20BrNO2/c1-22-18(21)17-15-9-14-6-7-16(17)20(14)10-12(15)8-11-2-4-13(19)5-3-11/h2-5,8,14-17H,6-7,9-10H2,1H3/b12-8+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112278 (9-(4-Trifluoromethyl-benzylidene)-7-aza-tricyclo[4...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(cc1)C(F)(F)F |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C19H20F3NO2/c1-25-18(24)17-15-9-14-6-7-16(17)23(14)10-12(15)8-11-2-4-13(5-3-11)19(20,21)22/h2-5,8,14-17H,6-7,9-10H2,1H3/b12-8+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	12.6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112298 (9-(4-Methyl-benzylidene)-7-aza-tricyclo[4.3.1.0*3,...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(C)cc1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C19H23NO2/c1-12-3-5-13(6-4-12)9-14-11-20-15-7-8-17(20)18(16(14)10-15)19(21)22-2/h3-6,9,15-18H,7-8,10-11H2,1-2H3/b14-9+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112269 (9-(3,4-Dichloro-benzylidene)-7-aza-tricyclo[4.3.1....) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(Cl)c(Cl)c1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C18H19Cl2NO2/c1-23-18(22)17-13-8-12-3-5-16(17)21(12)9-11(13)6-10-2-4-14(19)15(20)7-10/h2,4,6-7,12-13,16-17H,3,5,8-9H2,1H3/b11-6+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112275 (9-Naphthalen-2-ylmethylene-7-aza-tricyclo[4.3.1.0*...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc2ccccc2c1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C22H23NO2/c1-25-22(24)21-19-12-18-8-9-20(21)23(18)13-17(19)11-14-6-7-15-4-2-3-5-16(15)10-14/h2-7,10-11,18-21H,8-9,12-13H2,1H3/b17-11+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	21	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112291 (Acetic acid 9-(4-iodo-benzylidene)-7-aza-tricyclo[...) Show SMILES CC(=O)OCC1C2CCC3CC1\C(CN23)=C\c1ccc(I)cc1 |TLB:7:6:12.13:9.10,THB:4:5:12.13:9.10| Show InChI InChI=1S/C19H22INO2/c1-12(22)23-11-18-17-9-16-6-7-19(18)21(16)10-14(17)8-13-2-4-15(20)5-3-13/h2-5,8,16-19H,6-7,9-11H2,1H3/b14-8+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	21.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112268 (9-(3,4-Dichloro-benzylidene)-7-aza-tricyclo[4.3.1....) Show SMILES CN(C)C(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(Cl)c(Cl)c1 |TLB:7:6:12.13:9.10,THB:12:11:14:7.8,3:5:14:7.8,3:5:12.13:9.10,13:14:5.11.10:7.8| Show InChI InChI=1S/C19H22Cl2N2O/c1-22(2)19(24)18-14-9-13-4-6-17(18)23(13)10-12(14)7-11-3-5-15(20)16(21)8-11/h3,5,7-8,13-14,17-18H,4,6,9-10H2,1-2H3/b12-7+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	28.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112309 (9-(3,4-Dichloro-benzylidene)-7-aza-tricyclo[4.3.1....) Show SMILES CNC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(Cl)c(Cl)c1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C18H20Cl2N2O/c1-21-18(23)17-13-8-12-3-5-16(17)22(12)9-11(13)6-10-2-4-14(19)15(20)7-10/h2,4,6-7,12-13,16-17H,3,5,8-9H2,1H3,(H,21,23)/b11-6+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	29.8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112311 (9-(3,4-Dichloro-benzylidene)-7-aza-tricyclo[4.3.1....) Show SMILES CON(C)C(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(Cl)c(Cl)c1 |TLB:8:7:13.14:10.11,THB:13:12:15:8.9,4:6:15:8.9,4:6:13.14:10.11,14:15:6.12.11:8.9| Show InChI InChI=1S/C19H22Cl2N2O2/c1-22(25-2)19(24)18-14-9-13-4-6-17(18)23(13)10-12(14)7-11-3-5-15(20)16(21)8-11/h3,5,7-8,13-14,17-18H,4,6,9-10H2,1-2H3/b12-7+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	30.7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112277 (9-(4-Chloro-benzylidene)-7-aza-tricyclo[4.3.1.0*3,...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(Cl)cc1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C18H20ClNO2/c1-22-18(21)17-15-9-14-6-7-16(17)20(14)10-12(15)8-11-2-4-13(19)5-3-11/h2-5,8,14-17H,6-7,9-10H2,1H3/b12-8+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	34.3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112308 (9-(3,4-Dichloro-benzylidene)-7-aza-tricyclo[4.3.1....) Show SMILES Clc1ccc(\C=C2/CN3C4CCC3C(C2C4)C(=O)Oc2ccccc2)cc1Cl |TLB:6:14:8:11.10,16:13:8:11.10,16:13:6.7:9.15,THB:7:8:13.14.15:11.10,11:12:6.7:9.15| Show InChI InChI=1S/C23H21Cl2NO2/c24-19-8-6-14(11-20(19)25)10-15-13-26-16-7-9-21(26)22(18(15)12-16)23(27)28-17-4-2-1-3-5-17/h1-6,8,10-11,16,18,21-22H,7,9,12-13H2/b15-10+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	48.3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112296 (4-Iodo-benzoic acid 9-(3,4-dichloro-benzylidene)-7...) Show SMILES Clc1ccc(\C=C2/CN3C4CCC3C(COC(=O)c3ccc(I)cc3)C2C4)cc1Cl |TLB:14:13:6.7:9.26,THB:11:12:6.7:9.26| Show InChI InChI=1S/C24H22Cl2INO2/c25-21-7-1-14(10-22(21)26)9-16-12-28-18-6-8-23(28)20(19(16)11-18)13-30-24(29)15-2-4-17(27)5-3-15/h1-5,7,9-10,18-20,23H,6,8,11-13H2/b16-9+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	48.7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus)	BDBM50112299 (9-Benzylidene-7-aza-tricyclo[4.3.1.0*3,7*]decane-2...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccccc1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C18H21NO2/c1-21-18(20)17-15-10-14-7-8-16(17)19(14)11-13(15)9-12-5-3-2-4-6-12/h2-6,9,14-17H,7-8,10-11H2,1H3/b13-9+	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	53	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Ability to inhibit high affinity reuptake of [3H]-NE (Norepinephrine transporter) into nerve ending synaptosomes prepared from brain regions				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112285 (9-(3-Chloro-benzylidene)-7-aza-tricyclo[4.3.1.0*3,...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1cccc(Cl)c1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C18H20ClNO2/c1-22-18(21)17-15-9-14-5-6-16(17)20(14)10-12(15)7-11-3-2-4-13(19)8-11/h2-4,7-8,14-17H,5-6,9-10H2,1H3/b12-7+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	53.6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112294 (9-(4-Methoxy-benzylidene)-7-aza-tricyclo[4.3.1.0*3...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(OC)cc1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C19H23NO3/c1-22-15-6-3-12(4-7-15)9-13-11-20-14-5-8-17(20)18(16(13)10-14)19(21)23-2/h3-4,6-7,9,14,16-18H,5,8,10-11H2,1-2H3/b13-9+	PDB KEGG UniProtKB/SwissProt 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
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112300 (9-(2-Chloro-4-iodo-benzylidene)-7-aza-tricyclo[4.3...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(I)cc1Cl |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C18H19ClINO2/c1-23-18(22)17-14-8-13-4-5-16(17)21(13)9-11(14)6-10-2-3-12(20)7-15(10)19/h2-3,6-7,13-14,16-17H,4-5,8-9H2,1H3/b11-6+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	74	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112280 (9-(3,4-Dichloro-benzylidene)-7-aza-tricyclo[4.3.1....) Show SMILES CC(C)OC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(Cl)c(Cl)c1 |TLB:8:7:13.14:10.11,THB:13:12:15:8.9,4:6:15:8.9,4:6:13.14:10.11,14:15:6.12.11:8.9| Show InChI InChI=1S/C20H23Cl2NO2/c1-11(2)25-20(24)19-15-9-14-4-6-18(19)23(14)10-13(15)7-12-3-5-16(21)17(22)8-12/h3,5,7-8,11,14-15,18-19H,4,6,9-10H2,1-2H3/b13-7+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	85.7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112287 (Acetic acid 9-(3-chloro-benzylidene)-7-aza-tricycl...) Show SMILES CC(=O)OCC1C2CCC3CC1\C(CN23)=C\c1cccc(Cl)c1 |TLB:7:6:12.13:9.10,THB:4:5:12.13:9.10| Show InChI InChI=1S/C19H22ClNO2/c1-12(22)23-11-18-17-9-16-5-6-19(18)21(16)10-14(17)7-13-3-2-4-15(20)8-13/h2-4,7-8,16-19H,5-6,9-11H2,1H3/b14-7+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	92.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112290 (9-(3,4-Difluoro-benzylidene)-7-aza-tricyclo[4.3.1....) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(F)c(F)c1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C18H19F2NO2/c1-23-18(22)17-13-8-12-3-5-16(17)21(12)9-11(13)6-10-2-4-14(19)15(20)7-10/h2,4,6-7,12-13,16-17H,3,5,8-9H2,1H3/b11-6+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	101	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus)	BDBM50084717 ((+)-(1R,2R,3S,5S)-methyl 3-(benzoyloxy)-8-methyl-8...) Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1C(=O)Oc1ccccc1)N2C |THB:2:4:20:6.7| Show InChI InChI=1S/C17H21NO4/c1-18-11-8-9-14(18)15(17(20)21-2)13(10-11)16(19)22-12-6-4-3-5-7-12/h3-7,11,13-15H,8-10H2,1-2H3/t11?,13-,14?,15-/m0/s1	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	108	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Ability to inhibit high affinity reuptake of [3H]-NE (Norepinephrine transporter) into nerve ending synaptosomes prepared from brain regions				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112283 (9-Naphthalen-1-ylmethylene-7-aza-tricyclo[4.3.1.0*...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1cccc2ccccc12 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C22H23NO2/c1-25-22(24)21-19-12-17-9-10-20(21)23(17)13-16(19)11-15-7-4-6-14-5-2-3-8-18(14)15/h2-8,11,17,19-21H,9-10,12-13H2,1H3/b16-11+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	121	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus)	BDBM50112298 (9-(4-Methyl-benzylidene)-7-aza-tricyclo[4.3.1.0*3,...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(C)cc1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C19H23NO2/c1-12-3-5-13(6-4-12)9-14-11-20-15-7-8-17(20)18(16(14)10-15)19(21)22-2/h3-6,9,15-18H,7-8,10-11H2,1-2H3/b14-9+	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	146	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Ability to inhibit high affinity reuptake of [3H]-NE (Norepinephrine transporter) into nerve ending synaptosomes prepared from brain regions				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50084717 ((+)-(1R,2R,3S,5S)-methyl 3-(benzoyloxy)-8-methyl-8...) Show SMILES COC(=O)[C@@H]1C2CCC(C[C@@H]1C(=O)Oc1ccccc1)N2C |THB:2:4:20:6.7| Show InChI InChI=1S/C17H21NO4/c1-18-11-8-9-14(18)15(17(20)21-2)13(10-11)16(19)22-12-6-4-3-5-7-12/h3-7,11,13-15H,8-10H2,1-2H3/t11?,13-,14?,15-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	155	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus)	BDBM50112275 (9-Naphthalen-2-ylmethylene-7-aza-tricyclo[4.3.1.0*...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc2ccccc2c1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C22H23NO2/c1-25-22(24)21-19-12-18-8-9-20(21)23(18)13-17(19)11-14-6-7-15-4-2-3-5-16(15)10-14/h2-7,10-11,18-21H,8-9,12-13H2,1H3/b17-11+	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	157	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Ability to inhibit high affinity reuptake of [3H]-NE (Norepinephrine transporter) into nerve ending synaptosomes prepared from brain regions				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus)	BDBM30130 (CHEMBL1201082 | CHEMBL41 | Fluoxetin | Fluoxetine ...) Show SMILES CNCCC(Oc1ccc(cc1)C(F)(F)F)c1ccccc1 Show InChI InChI=1S/C17H18F3NO/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20/h2-10,16,21H,11-12H2,1H3	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	PubMed	167	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Ability to inhibit high affinity reuptake of [3H]-NE (Norepinephrine transporter) into nerve ending synaptosomes prepared from brain regions				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus)	BDBM50112281 (9-(4-Bromo-benzylidene)-7-aza-tricyclo[4.3.1.0*3,7...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(Br)cc1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C18H20BrNO2/c1-22-18(21)17-15-9-14-6-7-16(17)20(14)10-12(15)8-11-2-4-13(19)5-3-11/h2-5,8,14-17H,6-7,9-10H2,1H3/b12-8+	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	178	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Ability to inhibit high affinity reuptake of [3H]-NE (Norepinephrine transporter) into nerve ending synaptosomes prepared from brain regions				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus)	BDBM50112294 (9-(4-Methoxy-benzylidene)-7-aza-tricyclo[4.3.1.0*3...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(OC)cc1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C19H23NO3/c1-22-15-6-3-12(4-7-15)9-13-11-20-14-5-8-17(20)18(16(13)10-14)19(21)23-2/h3-4,6-7,9,14,16-18H,5,8,10-11H2,1-2H3/b13-9+	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	187	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Ability to inhibit high affinity reuptake of [3H]-NE (Norepinephrine transporter) into nerve ending synaptosomes prepared from brain regions				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus)	BDBM50112293 (9-(3-Chloro-4-methyl-benzylidene)-7-aza-tricyclo[4...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(C)c(Cl)c1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C19H22ClNO2/c1-11-3-4-12(8-16(11)20)7-13-10-21-14-5-6-17(21)18(15(13)9-14)19(22)23-2/h3-4,7-8,14-15,17-18H,5-6,9-10H2,1-2H3/b13-7+	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	198	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Ability to inhibit high affinity reuptake of [3H]-NE (Norepinephrine transporter) into nerve ending synaptosomes prepared from brain regions				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus)	BDBM50112277 (9-(4-Chloro-benzylidene)-7-aza-tricyclo[4.3.1.0*3,...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc(Cl)cc1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C18H20ClNO2/c1-22-18(21)17-15-9-14-6-7-16(17)20(14)10-12(15)8-11-2-4-13(19)5-3-11/h2-5,8,14-17H,6-7,9-10H2,1H3/b12-8+	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	208	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Ability to inhibit high affinity reuptake of [3H]-NE (Norepinephrine transporter) into nerve ending synaptosomes prepared from brain regions				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus)	BDBM50112291 (Acetic acid 9-(4-iodo-benzylidene)-7-aza-tricyclo[...) Show SMILES CC(=O)OCC1C2CCC3CC1\C(CN23)=C\c1ccc(I)cc1 |TLB:7:6:12.13:9.10,THB:4:5:12.13:9.10| Show InChI InChI=1S/C19H22INO2/c1-12(22)23-11-18-17-9-16-6-7-19(18)21(16)10-14(17)8-13-2-4-15(20)5-3-13/h2-5,8,16-19H,6-7,9-11H2,1H3/b14-8+	Reactome pathway KEGG UniProtKB/TrEMBL 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
Georgetown University Medical Center Curated by ChEMBL					Assay Description Ability to inhibit high affinity reuptake of [3H]-NE (Norepinephrine transporter) into nerve ending synaptosomes prepared from brain regions				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus)	BDBM50112285 (9-(3-Chloro-benzylidene)-7-aza-tricyclo[4.3.1.0*3,...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1cccc(Cl)c1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C18H20ClNO2/c1-22-18(21)17-15-9-14-5-6-16(17)20(14)10-12(15)7-11-3-2-4-13(19)8-11/h2-4,7-8,14-17H,5-6,9-10H2,1H3/b12-7+	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	231	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Ability to inhibit high affinity reuptake of [3H]-NE (Norepinephrine transporter) into nerve ending synaptosomes prepared from brain regions				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair

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