Compile Data Set for Download or QSAR

Found 70 hits with Last Name = 'król' and Initial = 'm'   

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))	BDBM50279520 (2-{4-[4-(1H-Indol-3-yl)-piperidin-1-yl]-butyl}-4-p...) Show SMILES Cc1ccc(cc1)-c1c2ccccn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccccc23)c1=O Show InChI InChI=1S/C32H34N4O2/c1-23-11-13-25(14-12-23)30-29-10-4-5-18-35(29)32(38)36(31(30)37)19-7-6-17-34-20-15-24(16-21-34)27-22-33-28-9-3-2-8-26(27)28/h2-5,8-14,18,22,24,33H,6-7,15-17,19-21H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from 5HTT in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50279541 (2-(4-(4-(1H-indol-3-yl)piperidin-1-yl)butyl)-4-(2-...) Show SMILES Fc1ccccc1-c1c2ccccn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccccc23)c1=O |(-3.9,-32.75,;-5.23,-31.98,;-5.23,-30.44,;-6.57,-29.67,;-7.91,-30.46,;-7.9,-31.99,;-6.57,-32.75,;-6.56,-34.29,;-7.89,-35.07,;-9.23,-34.29,;-10.57,-35.07,;-10.57,-36.62,;-9.23,-37.39,;-7.89,-36.62,;-6.55,-37.39,;-6.55,-38.93,;-5.21,-36.61,;-3.88,-37.38,;-2.54,-36.61,;-1.21,-37.38,;.12,-36.61,;1.46,-37.38,;1.45,-38.93,;2.78,-39.7,;4.11,-38.94,;4.12,-37.39,;2.78,-36.61,;5.45,-39.71,;5.61,-41.24,;7.11,-41.56,;7.88,-40.23,;9.39,-39.92,;9.87,-38.46,;8.83,-37.31,;7.33,-37.63,;6.86,-39.08,;-5.21,-35.06,;-3.88,-34.29,)| Show InChI InChI=1S/C31H31FN4O2/c32-26-11-3-1-10-24(26)29-28-13-5-6-17-35(28)31(38)36(30(29)37)18-8-7-16-34-19-14-22(15-20-34)25-21-33-27-12-4-2-9-23(25)27/h1-6,9-13,17,21-22,33H,7-8,14-16,18-20H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.700	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from 5HTT in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50279541 (2-(4-(4-(1H-indol-3-yl)piperidin-1-yl)butyl)-4-(2-...) Show SMILES Fc1ccccc1-c1c2ccccn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccccc23)c1=O |(-3.9,-32.75,;-5.23,-31.98,;-5.23,-30.44,;-6.57,-29.67,;-7.91,-30.46,;-7.9,-31.99,;-6.57,-32.75,;-6.56,-34.29,;-7.89,-35.07,;-9.23,-34.29,;-10.57,-35.07,;-10.57,-36.62,;-9.23,-37.39,;-7.89,-36.62,;-6.55,-37.39,;-6.55,-38.93,;-5.21,-36.61,;-3.88,-37.38,;-2.54,-36.61,;-1.21,-37.38,;.12,-36.61,;1.46,-37.38,;1.45,-38.93,;2.78,-39.7,;4.11,-38.94,;4.12,-37.39,;2.78,-36.61,;5.45,-39.71,;5.61,-41.24,;7.11,-41.56,;7.88,-40.23,;9.39,-39.92,;9.87,-38.46,;8.83,-37.31,;7.33,-37.63,;6.86,-39.08,;-5.21,-35.06,;-3.88,-34.29,)| Show InChI InChI=1S/C31H31FN4O2/c32-26-11-3-1-10-24(26)29-28-13-5-6-17-35(28)31(38)36(30(29)37)18-8-7-16-34-19-14-22(15-20-34)25-21-33-27-12-4-2-9-23(25)27/h1-6,9-13,17,21-22,33H,7-8,14-16,18-20H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5HT1A receptor in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50279520 (2-{4-[4-(1H-Indol-3-yl)-piperidin-1-yl]-butyl}-4-p...) Show SMILES Cc1ccc(cc1)-c1c2ccccn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccccc23)c1=O Show InChI InChI=1S/C32H34N4O2/c1-23-11-13-25(14-12-23)30-29-10-4-5-18-35(29)32(38)36(31(30)37)19-7-6-17-34-20-15-24(16-21-34)27-22-33-28-9-3-2-8-26(27)28/h2-5,8-14,18,22,24,33H,6-7,15-17,19-21H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5HT1A receptor in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50279540 (4-(4-Fluoro-phenyl)-2-{4-[4-(1H-indol-3-yl)-piperi...) Show SMILES Fc1ccc(cc1)-c1c2ccccn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccccc23)c1=O Show InChI InChI=1S/C31H31FN4O2/c32-24-12-10-23(11-13-24)29-28-9-3-4-17-35(28)31(38)36(30(29)37)18-6-5-16-34-19-14-22(15-20-34)26-21-33-27-8-2-1-7-25(26)27/h1-4,7-13,17,21-22,33H,5-6,14-16,18-20H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5HT1A receptor in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50301431 (2-{4-[4-(5-Methoxy-1H-indol-3-yl)-piperidin-1-yl]-...) Show SMILES COc1ccc(cc1)-c1c2CCCCn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccc(OC)cc23)c1=O Show InChI InChI=1S/C33H40N4O4/c1-40-25-10-8-24(9-11-25)31-30-7-3-4-17-36(30)33(39)37(32(31)38)18-6-5-16-35-19-14-23(15-20-35)28-22-34-29-13-12-26(41-2)21-27(28)29/h8-13,21-23,34H,3-7,14-20H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	10.4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5-HT1A receptor in rat hippocampus				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50279561 (2-(4-(4-(1H-indol-3-yl)piperidin-1-yl)butyl)-4-phe...) Show SMILES O=c1c(-c2ccccc2)c2ccccn2c(=O)n1CCCCN1CCC(CC1)c1c[nH]c2ccccc12 Show InChI InChI=1S/C31H32N4O2/c36-30-29(24-10-2-1-3-11-24)28-14-6-7-18-34(28)31(37)35(30)19-9-8-17-33-20-15-23(16-21-33)26-22-32-27-13-5-4-12-25(26)27/h1-7,10-14,18,22-23,32H,8-9,15-17,19-21H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	10.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5HT1A receptor in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50301442 (4-(4-Fluoro-phenyl)-2-{4-[4-(5-methoxy-1H-indol-3-...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(-c5ccc(F)cc5)c5CCCCn5c4=O)CC3)c2c1 Show InChI InChI=1S/C32H37FN4O3/c1-40-25-11-12-28-26(20-25)27(21-34-28)22-13-18-35(19-14-22)15-4-5-17-37-31(38)30(23-7-9-24(33)10-8-23)29-6-2-3-16-36(29)32(37)39/h7-12,20-22,34H,2-6,13-19H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	13.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5-HT1A receptor in rat hippocampus				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50301429 (4-(4-Chloro-phenyl)-2-{4-[4-(5-methoxy-1H-indol-3-...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(-c5ccc(Cl)cc5)c5CCCCn5c4=O)CC3)c2c1 Show InChI InChI=1S/C32H37ClN4O3/c1-40-25-11-12-28-26(20-25)27(21-34-28)22-13-18-35(19-14-22)15-4-5-17-37-31(38)30(23-7-9-24(33)10-8-23)29-6-2-3-16-36(29)32(37)39/h7-12,20-22,34H,2-6,13-19H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	14.6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5-HT1A receptor in rat hippocampus				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50279586 (4-(2-fluorophenyl)-2-(4-(4-(5-methoxy-1H-indol-3-y...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(-c5ccccc5F)c5ccccn5c4=O)CC3)c2c1 |(9.93,-30.98,;8.42,-31.3,;7.94,-32.77,;8.98,-33.91,;8.5,-35.38,;6.99,-35.69,;6.22,-37.02,;4.71,-36.69,;4.56,-35.17,;3.22,-34.39,;1.89,-35.15,;.56,-34.38,;.57,-32.84,;-.77,-32.07,;-2.1,-32.84,;-3.43,-32.07,;-4.77,-32.84,;-6.1,-32.07,;-6.1,-30.52,;-4.77,-29.75,;-7.45,-29.74,;-7.45,-28.21,;-8.79,-27.45,;-8.8,-25.91,;-7.46,-25.13,;-6.12,-25.9,;-6.12,-27.44,;-4.79,-28.2,;-8.78,-30.52,;-10.12,-29.74,;-11.45,-30.52,;-11.45,-32.07,;-10.12,-32.84,;-8.78,-32.07,;-7.44,-32.84,;-7.44,-34.38,;1.89,-32.07,;3.23,-32.85,;5.97,-34.54,;6.44,-33.09,)| Show InChI InChI=1S/C32H33FN4O3/c1-40-23-11-12-28-25(20-23)26(21-34-28)22-13-18-35(19-14-22)15-6-7-17-37-31(38)30(24-8-2-3-9-27(24)33)29-10-4-5-16-36(29)32(37)39/h2-5,8-12,16,20-22,34H,6-7,13-15,17-19H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	16.7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5HT1A receptor in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50301432 (2-{4-[4-(1H-Indol-3-yl)-piperidin-1-yl]-butyl}-4-(...) Show SMILES COc1ccc(cc1)-c1c2CCCCn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccccc23)c1=O Show InChI InChI=1S/C32H38N4O3/c1-39-25-13-11-24(12-14-25)30-29-10-4-5-18-35(29)32(38)36(31(30)37)19-7-6-17-34-20-15-23(16-21-34)27-22-33-28-9-3-2-8-26(27)28/h2-3,8-9,11-14,22-23,33H,4-7,10,15-21H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	20.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5-HT1A receptor in rat hippocampus				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50301446 (2-{4-[4-(5-Methoxy-1H-indol-3-yl)-piperidin-1-yl]-...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(-c5ccc(C)cc5)c5CCCCn5c4=O)CC3)c2c1 Show InChI InChI=1S/C33H40N4O3/c1-23-8-10-25(11-9-23)31-30-7-3-4-17-36(30)33(39)37(32(31)38)18-6-5-16-35-19-14-24(15-20-35)28-22-34-29-13-12-26(40-2)21-27(28)29/h8-13,21-22,24,34H,3-7,14-20H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	23	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5-HT1A receptor in rat hippocampus				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50301445 (4-(2-Fluoro-phenyl)-2-{4-[4-(1H-indol-3-yl)-piperi...) Show SMILES Fc1ccccc1-c1c2CCCCn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccccc23)c1=O |(-1.48,-44.82,;-2.82,-44.05,;-2.82,-42.5,;-4.16,-41.74,;-5.49,-42.51,;-5.49,-44.05,;-4.16,-44.82,;-4.16,-46.36,;-5.49,-47.13,;-6.81,-46.36,;-8.14,-47.12,;-8.15,-48.65,;-6.82,-49.43,;-5.5,-48.66,;-4.17,-49.44,;-4.18,-50.98,;-2.83,-48.68,;-1.5,-49.45,;-.16,-48.69,;1.17,-49.47,;2.5,-48.7,;3.83,-49.48,;3.81,-51.01,;5.14,-51.79,;6.48,-51.03,;6.49,-49.49,;5.16,-48.71,;7.8,-51.82,;7.96,-53.35,;9.46,-53.68,;10.24,-52.36,;11.74,-52.06,;12.24,-50.6,;11.21,-49.44,;9.71,-49.75,;9.22,-51.2,;-2.82,-47.13,;-1.49,-46.36,)| Show InChI InChI=1S/C31H35FN4O2/c32-26-11-3-1-10-24(26)29-28-13-5-6-17-35(28)31(38)36(30(29)37)18-8-7-16-34-19-14-22(15-20-34)25-21-33-27-12-4-2-9-23(25)27/h1-4,9-12,21-22,33H,5-8,13-20H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	27.8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5-HT1A receptor in rat hippocampus				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50279585 (4-(4-fluorophenyl)-2-(4-(4-(5-methoxy-1H-indol-3-y...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(-c5ccc(F)cc5)c5ccccn5c4=O)CC3)c2c1 Show InChI InChI=1S/C32H33FN4O3/c1-40-25-11-12-28-26(20-25)27(21-34-28)22-13-18-35(19-14-22)15-4-5-17-37-31(38)30(23-7-9-24(33)10-8-23)29-6-2-3-16-36(29)32(37)39/h2-3,6-12,16,20-22,34H,4-5,13-15,17-19H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	34.6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5HT1A receptor in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50301441 (4-(2-Chloro-phenyl)-2-{4-[4-(1H-indol-3-yl)-piperi...) Show SMILES Clc1ccccc1-c1c2CCCCn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccccc23)c1=O |(-4.37,-5.8,;-5.71,-5.03,;-5.71,-3.48,;-7.05,-2.72,;-8.38,-3.49,;-8.38,-5.04,;-7.05,-5.81,;-7.05,-7.35,;-8.39,-8.11,;-9.7,-7.35,;-11.03,-8.1,;-11.04,-9.64,;-9.71,-10.41,;-8.39,-9.65,;-7.06,-10.42,;-7.07,-11.96,;-5.72,-9.66,;-4.39,-10.44,;-3.06,-9.67,;-1.73,-10.45,;-.39,-9.69,;.94,-10.46,;.92,-12,;2.24,-12.77,;3.59,-12.02,;3.6,-10.48,;2.27,-9.69,;4.91,-12.8,;5.07,-14.33,;6.57,-14.66,;7.35,-13.34,;8.85,-13.04,;9.35,-11.58,;8.32,-10.43,;6.82,-10.73,;6.33,-12.18,;-5.71,-8.11,;-4.38,-7.35,)| Show InChI InChI=1S/C31H35ClN4O2/c32-26-11-3-1-10-24(26)29-28-13-5-6-17-35(28)31(38)36(30(29)37)18-8-7-16-34-19-14-22(15-20-34)25-21-33-27-12-4-2-9-23(25)27/h1-4,9-12,21-22,33H,5-8,13-20H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	36.2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5-HT1A receptor in rat hippocampus				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50279539 (4-(4-Chloro-phenyl)-2-{4-[4-(1H-indol-3-yl)-piperi...) Show SMILES Clc1ccc(cc1)-c1c2ccccn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccccc23)c1=O Show InChI InChI=1S/C31H31ClN4O2/c32-24-12-10-23(11-13-24)29-28-9-3-4-17-35(28)31(38)36(30(29)37)18-6-5-16-34-19-14-22(15-20-34)26-21-33-27-8-2-1-7-25(26)27/h1-4,7-13,17,21-22,33H,5-6,14-16,18-20H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	37.1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5HT1A receptor in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50279540 (4-(4-Fluoro-phenyl)-2-{4-[4-(1H-indol-3-yl)-piperi...) Show SMILES Fc1ccc(cc1)-c1c2ccccn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccccc23)c1=O Show InChI InChI=1S/C31H31FN4O2/c32-24-12-10-23(11-13-24)29-28-9-3-4-17-35(28)31(38)36(30(29)37)18-6-5-16-34-19-14-22(15-20-34)26-21-33-27-8-2-1-7-25(26)27/h1-4,7-13,17,21-22,33H,5-6,14-16,18-20H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	37.6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from 5HTT in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Rattus norvegicus (rat))	BDBM50088153 (4-Chloro-6-furan-3-yl-2-(4-methyl-piperazin-1-yl)-...) Show SMILES CN1CCN(CC1)c1nc(Cl)cc(n1)-c1ccoc1 Show InChI InChI=1S/C13H15ClN4O/c1-17-3-5-18(6-4-17)13-15-11(8-12(14)16-13)10-2-7-19-9-10/h2,7-9H,3-6H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	41	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Curated by ChEMBL					Assay Description Affinity 5-hydroxytryptamine 2A receptor of the rat brain cortex was assessed on the basis of their ability to displace [3H]-ketanserin				J Med Chem 43: 1901-9 (2000) BindingDB Entry DOI: 10.7270/Q2QF8S3H
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50279564 (4-(4-chlorophenyl)-2-(4-(4-(5-methoxy-1H-indol-3-y...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(-c5ccc(Cl)cc5)c5ccccn5c4=O)CC3)c2c1 Show InChI InChI=1S/C32H33ClN4O3/c1-40-25-11-12-28-26(20-25)27(21-34-28)22-13-18-35(19-14-22)15-4-5-17-37-31(38)30(23-7-9-24(33)10-8-23)29-6-2-3-16-36(29)32(37)39/h2-3,6-12,16,20-22,34H,4-5,13-15,17-19H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	41.1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5HT1A receptor in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50279519 (2-{4-[4-(1H-Indol-3-yl)-piperidin-1-yl]-butyl}-4-(...) Show SMILES COc1ccc(cc1)-c1c2ccccn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccccc23)c1=O Show InChI InChI=1S/C32H34N4O3/c1-39-25-13-11-24(12-14-25)30-29-10-4-5-18-35(29)32(38)36(31(30)37)19-7-6-17-34-20-15-23(16-21-34)27-22-33-28-9-3-2-8-26(27)28/h2-5,8-14,18,22-23,33H,6-7,15-17,19-21H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	42.1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5HT1A receptor in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50301430 (4-(2-Fluoro-phenyl)-2-{4-[4-(5-methoxy-1H-indol-3-...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(c5CCCCn5c4=O)-c4ccccc4F)CC3)c2c1 |(34.52,-24.97,;33.01,-25.27,;32.53,-26.73,;33.55,-27.89,;33.06,-29.35,;31.55,-29.65,;30.77,-30.97,;29.27,-30.64,;29.12,-29.11,;27.79,-28.32,;26.45,-29.08,;25.13,-28.3,;25.14,-26.77,;23.82,-25.99,;22.48,-26.76,;21.15,-25.98,;19.81,-26.74,;18.48,-25.97,;18.49,-24.42,;19.83,-23.65,;17.16,-23.65,;15.82,-24.42,;14.5,-23.65,;13.17,-24.41,;13.17,-25.94,;14.49,-26.72,;15.81,-25.95,;17.14,-26.73,;17.13,-28.27,;17.15,-22.11,;15.82,-21.34,;15.83,-19.8,;17.15,-19.03,;18.49,-19.79,;18.5,-21.34,;19.83,-22.11,;26.47,-26,;27.8,-26.78,;30.54,-28.49,;31.02,-27.04,)| Show InChI InChI=1S/C32H37FN4O3/c1-40-23-11-12-28-25(20-23)26(21-34-28)22-13-18-35(19-14-22)15-6-7-17-37-31(38)30(24-8-2-3-9-27(24)33)29-10-4-5-16-36(29)32(37)39/h2-3,8-9,11-12,20-22,34H,4-7,10,13-19H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	45.6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5-HT1A receptor in rat hippocampus				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50301428 (2-{4-[4-(1H-Indol-3-yl)-piperidin-1-yl]-butyl}-4-p...) Show SMILES Cc1ccc(cc1)-c1c2CCCCn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccccc23)c1=O Show InChI InChI=1S/C32H38N4O2/c1-23-11-13-25(14-12-23)30-29-10-4-5-18-35(29)32(38)36(31(30)37)19-7-6-17-34-20-15-24(16-21-34)27-22-33-28-9-3-2-8-26(27)28/h2-3,8-9,11-14,22,24,33H,4-7,10,15-21H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	48.3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5-HT1A receptor in rat hippocampus				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50301443 (2-{4-[4-(5-Methoxy-1H-indol-3-yl)-piperidin-1-yl]-...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(c5CCCCn5c4=O)-c4ccccc4C)CC3)c2c1 |(9.86,1.66,;8.35,1.35,;7.86,-.11,;8.88,-1.26,;8.39,-2.72,;6.88,-3.02,;6.11,-4.34,;4.61,-4.01,;4.45,-2.48,;3.12,-1.7,;1.78,-2.46,;.46,-1.68,;.48,-.14,;-.85,.63,;-2.19,-.13,;-3.52,.65,;-4.86,-.12,;-6.19,.66,;-6.18,2.2,;-4.84,2.97,;-7.51,2.97,;-8.85,2.21,;-10.16,2.97,;-11.5,2.22,;-11.5,.68,;-10.18,-.09,;-8.85,.67,;-7.52,-.11,;-7.53,-1.65,;-7.51,4.51,;-8.84,5.28,;-8.84,6.83,;-7.52,7.6,;-6.18,6.83,;-6.17,5.28,;-4.84,4.51,;1.8,.63,;3.13,-.16,;5.87,-1.86,;6.36,-.41,)| Show InChI InChI=1S/C33H40N4O3/c1-23-9-3-4-10-26(23)31-30-11-5-6-17-36(30)33(39)37(32(31)38)18-8-7-16-35-19-14-24(15-20-35)28-22-34-29-13-12-25(40-2)21-27(28)29/h3-4,9-10,12-13,21-22,24,34H,5-8,11,14-20H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	51.7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5-HT1A receptor in rat hippocampus				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50279587 (2-(4-(4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl)bu...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(-c5ccccc5)c5ccccn5c4=O)CC3)c2c1 Show InChI InChI=1S/C32H34N4O3/c1-39-25-12-13-28-26(21-25)27(22-33-28)23-14-19-34(20-15-23)16-7-8-18-36-31(37)30(24-9-3-2-4-10-24)29-11-5-6-17-35(29)32(36)38/h2-6,9-13,17,21-23,33H,7-8,14-16,18-20H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	52.3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5HT1A receptor in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50301444 (2-{4-[4-(1H-Indol-3-yl)-piperidin-1-yl]-butyl}-4-o...) Show SMILES Cc1ccccc1-c1c2CCCCn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccccc23)c1=O |(21.59,-46.69,;20.25,-45.92,;20.25,-44.37,;18.9,-43.61,;17.58,-44.38,;17.58,-45.93,;18.91,-46.7,;18.91,-48.24,;17.57,-49,;16.26,-48.24,;14.93,-48.99,;14.92,-50.53,;16.25,-51.3,;17.57,-50.54,;18.9,-51.32,;18.89,-52.86,;20.24,-50.55,;21.57,-51.33,;22.9,-50.56,;24.23,-51.34,;25.57,-50.58,;26.9,-51.35,;26.88,-52.89,;28.2,-53.66,;29.55,-52.91,;29.56,-51.37,;28.23,-50.58,;30.87,-53.69,;31.03,-55.22,;32.53,-55.55,;33.31,-54.23,;34.81,-53.93,;35.31,-52.47,;34.28,-51.32,;32.78,-51.62,;32.29,-53.07,;20.24,-49,;21.58,-48.24,)| Show InChI InChI=1S/C32H38N4O2/c1-23-10-2-3-11-25(23)30-29-14-6-7-18-35(29)32(38)36(31(30)37)19-9-8-17-34-20-15-24(16-21-34)27-22-33-28-13-5-4-12-26(27)28/h2-5,10-13,22,24,33H,6-9,14-21H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	53.8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5-HT1A receptor in rat hippocampus				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50279585 (4-(4-fluorophenyl)-2-(4-(4-(5-methoxy-1H-indol-3-y...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(-c5ccc(F)cc5)c5ccccn5c4=O)CC3)c2c1 Show InChI InChI=1S/C32H33FN4O3/c1-40-25-11-12-28-26(20-25)27(21-34-28)22-13-18-35(19-14-22)15-4-5-17-37-31(38)30(23-7-9-24(33)10-8-23)29-6-2-3-16-36(29)32(37)39/h2-3,6-12,16,20-22,34H,4-5,13-15,17-19H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	54.6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from 5HTT in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50279561 (2-(4-(4-(1H-indol-3-yl)piperidin-1-yl)butyl)-4-phe...) Show SMILES O=c1c(-c2ccccc2)c2ccccn2c(=O)n1CCCCN1CCC(CC1)c1c[nH]c2ccccc12 Show InChI InChI=1S/C31H32N4O2/c36-30-29(24-10-2-1-3-11-24)28-14-6-7-18-34(28)31(37)35(30)19-9-8-17-33-20-15-23(16-21-33)26-22-32-27-13-5-4-12-25(26)27/h1-7,10-14,18,22-23,32H,8-9,15-17,19-21H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	58.1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from 5HTT in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50279563 (2-(4-(4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl)bu...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(-c5ccc(C)cc5)c5ccccn5c4=O)CC3)c2c1 Show InChI InChI=1S/C33H36N4O3/c1-23-8-10-25(11-9-23)31-30-7-3-4-17-36(30)33(39)37(32(31)38)18-6-5-16-35-19-14-24(15-20-35)28-22-34-29-13-12-26(40-2)21-27(28)29/h3-4,7-13,17,21-22,24,34H,5-6,14-16,18-20H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	59	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5HT1A receptor in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50279586 (4-(2-fluorophenyl)-2-(4-(4-(5-methoxy-1H-indol-3-y...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(-c5ccccc5F)c5ccccn5c4=O)CC3)c2c1 |(9.93,-30.98,;8.42,-31.3,;7.94,-32.77,;8.98,-33.91,;8.5,-35.38,;6.99,-35.69,;6.22,-37.02,;4.71,-36.69,;4.56,-35.17,;3.22,-34.39,;1.89,-35.15,;.56,-34.38,;.57,-32.84,;-.77,-32.07,;-2.1,-32.84,;-3.43,-32.07,;-4.77,-32.84,;-6.1,-32.07,;-6.1,-30.52,;-4.77,-29.75,;-7.45,-29.74,;-7.45,-28.21,;-8.79,-27.45,;-8.8,-25.91,;-7.46,-25.13,;-6.12,-25.9,;-6.12,-27.44,;-4.79,-28.2,;-8.78,-30.52,;-10.12,-29.74,;-11.45,-30.52,;-11.45,-32.07,;-10.12,-32.84,;-8.78,-32.07,;-7.44,-32.84,;-7.44,-34.38,;1.89,-32.07,;3.23,-32.85,;5.97,-34.54,;6.44,-33.09,)| Show InChI InChI=1S/C32H33FN4O3/c1-40-23-11-12-28-25(20-23)26(21-34-28)22-13-18-35(19-14-22)15-6-7-17-37-31(38)30(24-8-2-3-9-27(24)33)29-10-4-5-16-36(29)32(37)39/h2-5,8-12,16,20-22,34H,6-7,13-15,17-19H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	59.3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from 5HTT in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50301432 (2-{4-[4-(1H-Indol-3-yl)-piperidin-1-yl]-butyl}-4-(...) Show SMILES COc1ccc(cc1)-c1c2CCCCn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccccc23)c1=O Show InChI InChI=1S/C32H38N4O3/c1-39-25-13-11-24(12-14-25)30-29-10-4-5-18-35(29)32(38)36(31(30)37)19-7-6-17-34-20-15-23(16-21-34)27-22-33-28-9-3-2-8-26(27)28/h2-3,8-9,11-14,22-23,33H,4-7,10,15-21H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	71.6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from SERT in rat cerebral cortex by liquid scintillation counting				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50301442 (4-(4-Fluoro-phenyl)-2-{4-[4-(5-methoxy-1H-indol-3-...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(-c5ccc(F)cc5)c5CCCCn5c4=O)CC3)c2c1 Show InChI InChI=1S/C32H37FN4O3/c1-40-25-11-12-28-26(20-25)27(21-34-28)22-13-18-35(19-14-22)15-4-5-17-37-31(38)30(23-7-9-24(33)10-8-23)29-6-2-3-16-36(29)32(37)39/h7-12,20-22,34H,2-6,13-19H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	76.1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from SERT in rat cerebral cortex by liquid scintillation counting				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50301428 (2-{4-[4-(1H-Indol-3-yl)-piperidin-1-yl]-butyl}-4-p...) Show SMILES Cc1ccc(cc1)-c1c2CCCCn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccccc23)c1=O Show InChI InChI=1S/C32H38N4O2/c1-23-11-13-25(14-12-23)30-29-10-4-5-18-35(29)32(38)36(31(30)37)19-7-6-17-34-20-15-24(16-21-34)27-22-33-28-9-3-2-8-26(27)28/h2-3,8-9,11-14,22,24,33H,4-7,10,15-21H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	76.7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from SERT in rat cerebral cortex by liquid scintillation counting				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50279562 (2-(4-(4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl)bu...) Show SMILES COc1ccc(cc1)-c1c2ccccn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccc(OC)cc23)c1=O Show InChI InChI=1S/C33H36N4O4/c1-40-25-10-8-24(9-11-25)31-30-7-3-4-17-36(30)33(39)37(32(31)38)18-6-5-16-35-19-14-23(15-20-35)28-22-34-29-13-12-26(41-2)21-27(28)29/h3-4,7-13,17,21-23,34H,5-6,14-16,18-20H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	78	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5HT1A receptor in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50301431 (2-{4-[4-(5-Methoxy-1H-indol-3-yl)-piperidin-1-yl]-...) Show SMILES COc1ccc(cc1)-c1c2CCCCn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccc(OC)cc23)c1=O Show InChI InChI=1S/C33H40N4O4/c1-40-25-10-8-24(9-11-25)31-30-7-3-4-17-36(30)33(39)37(32(31)38)18-6-5-16-35-19-14-23(15-20-35)28-22-34-29-13-12-26(41-2)21-27(28)29/h8-13,21-23,34H,3-7,14-20H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	83.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from SERT in rat cerebral cortex by liquid scintillation counting				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50301441 (4-(2-Chloro-phenyl)-2-{4-[4-(1H-indol-3-yl)-piperi...) Show SMILES Clc1ccccc1-c1c2CCCCn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccccc23)c1=O |(-4.37,-5.8,;-5.71,-5.03,;-5.71,-3.48,;-7.05,-2.72,;-8.38,-3.49,;-8.38,-5.04,;-7.05,-5.81,;-7.05,-7.35,;-8.39,-8.11,;-9.7,-7.35,;-11.03,-8.1,;-11.04,-9.64,;-9.71,-10.41,;-8.39,-9.65,;-7.06,-10.42,;-7.07,-11.96,;-5.72,-9.66,;-4.39,-10.44,;-3.06,-9.67,;-1.73,-10.45,;-.39,-9.69,;.94,-10.46,;.92,-12,;2.24,-12.77,;3.59,-12.02,;3.6,-10.48,;2.27,-9.69,;4.91,-12.8,;5.07,-14.33,;6.57,-14.66,;7.35,-13.34,;8.85,-13.04,;9.35,-11.58,;8.32,-10.43,;6.82,-10.73,;6.33,-12.18,;-5.71,-8.11,;-4.38,-7.35,)| Show InChI InChI=1S/C31H35ClN4O2/c32-26-11-3-1-10-24(26)29-28-13-5-6-17-35(28)31(38)36(30(29)37)18-8-7-16-34-19-14-22(15-20-34)25-21-33-27-12-4-2-9-23(25)27/h1-4,9-12,21-22,33H,5-8,13-20H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	101	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from SERT in rat cerebral cortex by liquid scintillation counting				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50301445 (4-(2-Fluoro-phenyl)-2-{4-[4-(1H-indol-3-yl)-piperi...) Show SMILES Fc1ccccc1-c1c2CCCCn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccccc23)c1=O |(-1.48,-44.82,;-2.82,-44.05,;-2.82,-42.5,;-4.16,-41.74,;-5.49,-42.51,;-5.49,-44.05,;-4.16,-44.82,;-4.16,-46.36,;-5.49,-47.13,;-6.81,-46.36,;-8.14,-47.12,;-8.15,-48.65,;-6.82,-49.43,;-5.5,-48.66,;-4.17,-49.44,;-4.18,-50.98,;-2.83,-48.68,;-1.5,-49.45,;-.16,-48.69,;1.17,-49.47,;2.5,-48.7,;3.83,-49.48,;3.81,-51.01,;5.14,-51.79,;6.48,-51.03,;6.49,-49.49,;5.16,-48.71,;7.8,-51.82,;7.96,-53.35,;9.46,-53.68,;10.24,-52.36,;11.74,-52.06,;12.24,-50.6,;11.21,-49.44,;9.71,-49.75,;9.22,-51.2,;-2.82,-47.13,;-1.49,-46.36,)| Show InChI InChI=1S/C31H35FN4O2/c32-26-11-3-1-10-24(26)29-28-13-5-6-17-35(28)31(38)36(30(29)37)18-8-7-16-34-19-14-22(15-20-34)25-21-33-27-12-4-2-9-23(25)27/h1-4,9-12,21-22,33H,5-8,13-20H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	102	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from SERT in rat cerebral cortex by liquid scintillation counting				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50301437 (2-{4-[4-(2-Methyl-1H-indol-3-yl)-piperidin-1-yl]-b...) Show SMILES Cc1[nH]c2ccccc2c1C1CCN(CCCCn2c(=O)c(-c3ccc(C)cc3)c3CCCCn3c2=O)CC1 Show InChI InChI=1S/C33H40N4O2/c1-23-12-14-25(15-13-23)31-29-11-5-6-19-36(29)33(39)37(32(31)38)20-8-7-18-35-21-16-26(17-22-35)30-24(2)34-28-10-4-3-9-27(28)30/h3-4,9-10,12-15,26,34H,5-8,11,16-22H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	115	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from SERT in rat cerebral cortex by liquid scintillation counting				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50301433 (4-(4-Fluoro-phenyl)-2-{4-[4-(2-methyl-1H-indol-3-y...) Show SMILES Cc1[nH]c2ccccc2c1C1CCN(CCCCn2c(=O)c(-c3ccc(F)cc3)c3CCCCn3c2=O)CC1 Show InChI InChI=1S/C32H37FN4O2/c1-22-29(26-8-2-3-9-27(26)34-22)24-15-20-35(21-16-24)17-6-7-19-37-31(38)30(23-11-13-25(33)14-12-23)28-10-4-5-18-36(28)32(37)39/h2-3,8-9,11-14,24,34H,4-7,10,15-21H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	116	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from SERT in rat cerebral cortex by liquid scintillation counting				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50301444 (2-{4-[4-(1H-Indol-3-yl)-piperidin-1-yl]-butyl}-4-o...) Show SMILES Cc1ccccc1-c1c2CCCCn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccccc23)c1=O |(21.59,-46.69,;20.25,-45.92,;20.25,-44.37,;18.9,-43.61,;17.58,-44.38,;17.58,-45.93,;18.91,-46.7,;18.91,-48.24,;17.57,-49,;16.26,-48.24,;14.93,-48.99,;14.92,-50.53,;16.25,-51.3,;17.57,-50.54,;18.9,-51.32,;18.89,-52.86,;20.24,-50.55,;21.57,-51.33,;22.9,-50.56,;24.23,-51.34,;25.57,-50.58,;26.9,-51.35,;26.88,-52.89,;28.2,-53.66,;29.55,-52.91,;29.56,-51.37,;28.23,-50.58,;30.87,-53.69,;31.03,-55.22,;32.53,-55.55,;33.31,-54.23,;34.81,-53.93,;35.31,-52.47,;34.28,-51.32,;32.78,-51.62,;32.29,-53.07,;20.24,-49,;21.58,-48.24,)| Show InChI InChI=1S/C32H38N4O2/c1-23-10-2-3-11-25(23)30-29-14-6-7-18-35(29)32(38)36(31(30)37)19-9-8-17-34-20-15-24(16-21-34)27-22-33-28-13-5-4-12-26(27)28/h2-5,10-13,22,24,33H,6-9,14-21H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	124	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from SERT in rat cerebral cortex by liquid scintillation counting				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50301443 (2-{4-[4-(5-Methoxy-1H-indol-3-yl)-piperidin-1-yl]-...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(c5CCCCn5c4=O)-c4ccccc4C)CC3)c2c1 |(9.86,1.66,;8.35,1.35,;7.86,-.11,;8.88,-1.26,;8.39,-2.72,;6.88,-3.02,;6.11,-4.34,;4.61,-4.01,;4.45,-2.48,;3.12,-1.7,;1.78,-2.46,;.46,-1.68,;.48,-.14,;-.85,.63,;-2.19,-.13,;-3.52,.65,;-4.86,-.12,;-6.19,.66,;-6.18,2.2,;-4.84,2.97,;-7.51,2.97,;-8.85,2.21,;-10.16,2.97,;-11.5,2.22,;-11.5,.68,;-10.18,-.09,;-8.85,.67,;-7.52,-.11,;-7.53,-1.65,;-7.51,4.51,;-8.84,5.28,;-8.84,6.83,;-7.52,7.6,;-6.18,6.83,;-6.17,5.28,;-4.84,4.51,;1.8,.63,;3.13,-.16,;5.87,-1.86,;6.36,-.41,)| Show InChI InChI=1S/C33H40N4O3/c1-23-9-3-4-10-26(23)31-30-11-5-6-17-36(30)33(39)37(32(31)38)18-8-7-16-35-19-14-24(15-20-35)28-22-34-29-13-12-25(40-2)21-27(28)29/h3-4,9-10,12-13,21-22,24,34H,5-8,11,14-20H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	124	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from SERT in rat cerebral cortex by liquid scintillation counting				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50279587 (2-(4-(4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl)bu...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(-c5ccccc5)c5ccccn5c4=O)CC3)c2c1 Show InChI InChI=1S/C32H34N4O3/c1-39-25-12-13-28-26(21-25)27(22-33-28)23-14-19-34(20-15-23)16-7-8-18-36-31(37)30(24-9-3-2-4-10-24)29-11-5-6-17-35(29)32(36)38/h2-6,9-13,17,21-23,33H,7-8,14-16,18-20H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	129	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from 5HTT in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50279562 (2-(4-(4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl)bu...) Show SMILES COc1ccc(cc1)-c1c2ccccn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccc(OC)cc23)c1=O Show InChI InChI=1S/C33H36N4O4/c1-40-25-10-8-24(9-11-25)31-30-7-3-4-17-36(30)33(39)37(32(31)38)18-6-5-16-35-19-14-23(15-20-35)28-22-34-29-13-12-26(41-2)21-27(28)29/h3-4,7-13,17,21-23,34H,5-6,14-16,18-20H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	129	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from 5HTT in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50301446 (2-{4-[4-(5-Methoxy-1H-indol-3-yl)-piperidin-1-yl]-...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(-c5ccc(C)cc5)c5CCCCn5c4=O)CC3)c2c1 Show InChI InChI=1S/C33H40N4O3/c1-23-8-10-25(11-9-23)31-30-7-3-4-17-36(30)33(39)37(32(31)38)18-6-5-16-35-19-14-24(15-20-35)28-22-34-29-13-12-26(40-2)21-27(28)29/h8-13,21-22,24,34H,3-7,14-20H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	136	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from SERT in rat cerebral cortex by liquid scintillation counting				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50279519 (2-{4-[4-(1H-Indol-3-yl)-piperidin-1-yl]-butyl}-4-(...) Show SMILES COc1ccc(cc1)-c1c2ccccn2c(=O)n(CCCCN2CCC(CC2)c2c[nH]c3ccccc23)c1=O Show InChI InChI=1S/C32H34N4O3/c1-39-25-13-11-24(12-14-25)30-29-10-4-5-18-35(29)32(38)36(31(30)37)19-7-6-17-34-20-15-23(16-21-34)27-22-33-28-9-3-2-8-26(27)28/h2-5,8-14,18,22-23,33H,6-7,15-17,19-21H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	145	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from 5HTT in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50301430 (4-(2-Fluoro-phenyl)-2-{4-[4-(5-methoxy-1H-indol-3-...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(c5CCCCn5c4=O)-c4ccccc4F)CC3)c2c1 |(34.52,-24.97,;33.01,-25.27,;32.53,-26.73,;33.55,-27.89,;33.06,-29.35,;31.55,-29.65,;30.77,-30.97,;29.27,-30.64,;29.12,-29.11,;27.79,-28.32,;26.45,-29.08,;25.13,-28.3,;25.14,-26.77,;23.82,-25.99,;22.48,-26.76,;21.15,-25.98,;19.81,-26.74,;18.48,-25.97,;18.49,-24.42,;19.83,-23.65,;17.16,-23.65,;15.82,-24.42,;14.5,-23.65,;13.17,-24.41,;13.17,-25.94,;14.49,-26.72,;15.81,-25.95,;17.14,-26.73,;17.13,-28.27,;17.15,-22.11,;15.82,-21.34,;15.83,-19.8,;17.15,-19.03,;18.49,-19.79,;18.5,-21.34,;19.83,-22.11,;26.47,-26,;27.8,-26.78,;30.54,-28.49,;31.02,-27.04,)| Show InChI InChI=1S/C32H37FN4O3/c1-40-23-11-12-28-25(20-23)26(21-34-28)22-13-18-35(19-14-22)15-6-7-17-37-31(38)30(24-8-2-3-9-27(24)33)29-10-4-5-16-36(29)32(37)39/h2-3,8-9,11-12,20-22,34H,4-7,10,13-19H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	184	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from SERT in rat cerebral cortex by liquid scintillation counting				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50301436 (4-(4-Methoxy-phenyl)-2-{4-[4-(2-methyl-1H-indol-3-...) Show SMILES COc1ccc(cc1)-c1c2CCCCn2c(=O)n(CCCCN2CCC(CC2)c2c(C)[nH]c3ccccc23)c1=O Show InChI InChI=1S/C33H40N4O3/c1-23-30(27-9-3-4-10-28(27)34-23)25-16-21-35(22-17-25)18-7-8-20-37-32(38)31(24-12-14-26(40-2)15-13-24)29-11-5-6-19-36(29)33(37)39/h3-4,9-10,12-15,25,34H,5-8,11,16-22H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	203	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from SERT in rat cerebral cortex by liquid scintillation counting				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50301429 (4-(4-Chloro-phenyl)-2-{4-[4-(5-methoxy-1H-indol-3-...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(-c5ccc(Cl)cc5)c5CCCCn5c4=O)CC3)c2c1 Show InChI InChI=1S/C32H37ClN4O3/c1-40-25-11-12-28-26(20-25)27(21-34-28)22-13-18-35(19-14-22)15-4-5-17-37-31(38)30(23-7-9-24(33)10-8-23)29-6-2-3-16-36(29)32(37)39/h7-12,20-22,34H,2-6,13-19H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	222	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from SERT in rat cerebral cortex by liquid scintillation counting				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50279563 (2-(4-(4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl)bu...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(-c5ccc(C)cc5)c5ccccn5c4=O)CC3)c2c1 Show InChI InChI=1S/C33H36N4O3/c1-23-8-10-25(11-9-23)31-30-7-3-4-17-36(30)33(39)37(32(31)38)18-6-5-16-35-19-14-24(15-20-35)28-22-34-29-13-12-26(40-2)21-27(28)29/h3-4,7-13,17,21-22,24,34H,5-6,14-16,18-20H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	223	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from 5HTT in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50279564 (4-(4-chlorophenyl)-2-(4-(4-(5-methoxy-1H-indol-3-y...) Show SMILES COc1ccc2[nH]cc(C3CCN(CCCCn4c(=O)c(-c5ccc(Cl)cc5)c5ccccn5c4=O)CC3)c2c1 Show InChI InChI=1S/C32H33ClN4O3/c1-40-25-11-12-28-26(20-25)27(21-34-28)22-13-18-35(19-14-22)15-4-5-17-37-31(38)30(23-7-9-24(33)10-8-23)29-6-2-3-16-36(29)32(37)39/h2-3,6-12,16,20-22,34H,4-5,13-15,17-19H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	251	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from 5HTT in rat brain membranes				Eur J Med Chem 44: 1710-7 (2009) Article DOI: 10.1016/j.ejmech.2008.09.021 BindingDB Entry DOI: 10.7270/Q22N5249
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50301439 (2-{4-[4-(2-Methyl-1H-indol-3-yl)-piperidin-1-yl]-b...) Show SMILES Cc1[nH]c2ccccc2c1C1CCN(CCCCn2c(=O)c(-c3ccccc3)c3CCCCn3c2=O)CC1 Show InChI InChI=1S/C32H38N4O2/c1-23-29(26-13-5-6-14-27(26)33-23)25-16-21-34(22-17-25)18-9-10-20-36-31(37)30(24-11-3-2-4-12-24)28-15-7-8-19-35(28)32(36)38/h2-6,11-14,25,33H,7-10,15-22H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	274	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Medical University of Warsaw Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from SERT in rat cerebral cortex by liquid scintillation counting				Eur J Med Chem 44: 4702-15 (2009) Article DOI: 10.1016/j.ejmech.2009.07.007 BindingDB Entry DOI: 10.7270/Q28C9W93
					More data for this Ligand-Target Pair

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