Compile Data Set for Download or QSAR

Found 109 hits with Last Name = 'yabuuchi' and Initial = 'k'   

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 (Homo sapiens (Human))	BDBM22416 ((3S,4R)-3-[(1,3-benzodioxol-5-yloxy)methyl]-4-(4-f...) Show SMILES Fc1ccc(cc1)[C@@H]1CCNC[C@H]1COc1ccc2OCOc2c1 Show InChI InChI=1S/C19H20FNO3/c20-15-3-1-13(2-4-15)17-7-8-21-10-14(17)11-22-16-5-6-18-19(9-16)24-12-23-18/h1-6,9,14,17,21H,7-8,10-12H2/t14-,17-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB Article PubMed	0.110	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from human SERT expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting method				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair				3D Structure (crystal)
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206761 (CHEMBL3958278) Show SMILES COc1ccc(Br)c(CC2CCN(CCc3ccc4OCCOc4c3)CC2)c1 Show InChI InChI=1S/C23H28BrNO3/c1-26-20-3-4-21(24)19(16-20)14-18-7-10-25(11-8-18)9-6-17-2-5-22-23(15-17)28-13-12-27-22/h2-5,15-16,18H,6-14H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.360	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50460160 (CHEMBL4229131) Show SMILES COCCOc1cc(CC2CCN(CCc3ccc4OCCC(=O)c4c3)CC2)ccc1I Show InChI InChI=1S/C26H32INO4/c1-30-14-15-32-26-18-21(2-4-23(26)27)16-20-7-11-28(12-8-20)10-6-19-3-5-25-22(17-19)24(29)9-13-31-25/h2-5,17-18,20H,6-16H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.410	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-citalopram from human SERT expressed in HEK293 cell membranes after 60 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50460148 (CHEMBL4226053) Show SMILES COCCOc1cc(CC2CCN(CCc3ccc4CCCC(=O)c4c3)CC2)ccc1Br Show InChI InChI=1S/C27H34BrNO3/c1-31-15-16-32-27-19-22(6-8-25(27)28)17-21-10-13-29(14-11-21)12-9-20-5-7-23-3-2-4-26(30)24(23)18-20/h5-8,18-19,21H,2-4,9-17H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.670	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-citalopram from human SERT expressed in HEK293 cell membranes after 60 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206755 (CHEMBL3940484) Show SMILES COc1ccc(CCN2CCC(Cc3cc(OC)ccc3Br)CC2)cc1 Show InChI InChI=1S/C22H28BrNO2/c1-25-20-5-3-17(4-6-20)9-12-24-13-10-18(11-14-24)15-19-16-21(26-2)7-8-22(19)23/h3-8,16,18H,9-15H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.810	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206797 (CHEMBL3974952) Show SMILES COc1cccc(CCN2CCC(Cc3cc(OC)ccc3Br)CC2)c1 Show InChI InChI=1S/C22H28BrNO2/c1-25-20-5-3-4-17(15-20)8-11-24-12-9-18(10-13-24)14-19-16-21(26-2)6-7-22(19)23/h3-7,15-16,18H,8-14H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.820	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206788 (CHEMBL3949638) Show SMILES COc1ccc(Br)c(CC2CCN(CCc3ccc4ccccc4c3)CC2)c1 Show InChI InChI=1S/C25H28BrNO/c1-28-24-8-9-25(26)23(18-24)17-20-11-14-27(15-12-20)13-10-19-6-7-21-4-2-3-5-22(21)16-19/h2-9,16,18,20H,10-15,17H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.890	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206759 (CHEMBL3964504) Show SMILES COc1ccc(Br)c(CC2CCN(CCc3ccc(F)cc3)CC2)c1 Show InChI InChI=1S/C21H25BrFNO/c1-25-20-6-7-21(22)18(15-20)14-17-9-12-24(13-10-17)11-8-16-2-4-19(23)5-3-16/h2-7,15,17H,8-14H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50460159 (CHEMBL4226281) Show SMILES COCCOc1cc(CC2CCN(CCc3ccc4OCCC(=O)c4c3)CC2)ccc1Br Show InChI InChI=1S/C26H32BrNO4/c1-30-14-15-32-26-18-21(2-4-23(26)27)16-20-7-11-28(12-8-20)10-6-19-3-5-25-22(17-19)24(29)9-13-31-25/h2-5,17-18,20H,6-16H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-citalopram from human SERT expressed in HEK293 cell membranes after 60 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206756 (CHEMBL3950161) Show SMILES COc1ccc(Br)c(CC2CCN(CCc3ccc(OC)c(Cl)c3)CC2)c1 Show InChI InChI=1S/C22H27BrClNO2/c1-26-19-4-5-20(23)18(15-19)13-17-8-11-25(12-9-17)10-7-16-3-6-22(27-2)21(24)14-16/h3-6,14-15,17H,7-13H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206753 (CHEMBL3940863) Show SMILES COc1ccc(CCN2CCC(Cc3cc(OC)ccc3Br)CC2)c(Cl)c1 Show InChI InChI=1S/C22H27BrClNO2/c1-26-19-5-6-21(23)18(14-19)13-16-7-10-25(11-8-16)12-9-17-3-4-20(27-2)15-22(17)24/h3-6,14-16H,7-13H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50460149 (CHEMBL4228477) Show SMILES COCCOc1cc(CC2CCN(CCc3ccc4OCCCC(=O)c4c3)CC2)ccc1Br Show InChI InChI=1S/C27H34BrNO4/c1-31-15-16-33-27-19-22(4-6-24(27)28)17-21-9-12-29(13-10-21)11-8-20-5-7-26-23(18-20)25(30)3-2-14-32-26/h4-7,18-19,21H,2-3,8-17H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-citalopram from human SERT expressed in HEK293 cell membranes after 60 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206775 (CHEMBL3982923) Show SMILES COc1ccc(Br)c(CC2CCN(CCc3ccc(Cl)cc3)CC2)c1 Show InChI InChI=1S/C21H25BrClNO/c1-25-20-6-7-21(22)18(15-20)14-17-9-12-24(13-10-17)11-8-16-2-4-19(23)5-3-16/h2-7,15,17H,8-14H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206772 (CHEMBL3942037) Show SMILES COc1ccc(Br)c(CC2CCN(CCc3ccc(C)cc3)CC2)c1 Show InChI InChI=1S/C22H28BrNO/c1-17-3-5-18(6-4-17)9-12-24-13-10-19(11-14-24)15-20-16-21(25-2)7-8-22(20)23/h3-8,16,19H,9-15H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50460147 (CHEMBL4226031) Show SMILES COCCOc1cc(CC2CCN(CCc3ccc4C(=O)CCOc4c3)CC2)ccc1Br Show InChI InChI=1S/C26H32BrNO4/c1-30-14-15-32-26-18-21(3-5-23(26)27)16-20-7-11-28(12-8-20)10-6-19-2-4-22-24(29)9-13-31-25(22)17-19/h2-5,17-18,20H,6-16H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-citalopram from human SERT expressed in HEK293 cell membranes after 60 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206785 (CHEMBL3963429) Show SMILES COc1ccc(Br)c(CC2CCN(CCc3ccc(OC)c(OC)c3)CC2)c1 Show InChI InChI=1S/C23H30BrNO3/c1-26-20-5-6-21(24)19(16-20)14-18-9-12-25(13-10-18)11-8-17-4-7-22(27-2)23(15-17)28-3/h4-7,15-16,18H,8-14H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50460146 (CHEMBL4226546) Show SMILES COCCOc1cc(CC2CCN(CCc3ccc4OCCCc4c3)CC2)ccc1Br Show InChI InChI=1S/C26H34BrNO3/c1-29-15-16-31-26-19-22(4-6-24(26)27)17-21-9-12-28(13-10-21)11-8-20-5-7-25-23(18-20)3-2-14-30-25/h4-7,18-19,21H,2-3,8-17H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-citalopram from human SERT expressed in HEK293 cell membranes after 60 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50010859 (CHEMBL11 | IMIPRAMINE HYDROCHLORIDE | IMIPRAMINE P...) Show SMILES CN(C)CCCN1c2ccccc2CCc2ccccc12 Show InChI InChI=1S/C19H24N2/c1-20(2)14-7-15-21-18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)21/h3-6,8-11H,7,12-15H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from human SERT expressed in HEK293 cell membranes after 1 hr by liquid scintillation counting method				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair				3D Structure (crystal)
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206763 (CHEMBL3912020) Show SMILES COc1ccc(Br)c(CC2CCN(CCc3cc(OC)c(OC)cc3Cl)CC2)c1 Show InChI InChI=1S/C23H29BrClNO3/c1-27-19-4-5-20(24)18(13-19)12-16-6-9-26(10-7-16)11-8-17-14-22(28-2)23(29-3)15-21(17)25/h4-5,13-16H,6-12H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206757 (CHEMBL3921860) Show SMILES COc1ccc(Br)c(CC2CCN(CCc3cccc4OCCOc34)CC2)c1 Show InChI InChI=1S/C23H28BrNO3/c1-26-20-5-6-21(24)19(16-20)15-17-7-10-25(11-8-17)12-9-18-3-2-4-22-23(18)28-14-13-27-22/h2-6,16-17H,7-15H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206762 (CHEMBL3894524) Show SMILES COc1ccc(Cl)c(CC2CCN(CCc3ccccc3)CC2)c1 Show InChI InChI=1S/C21H26ClNO/c1-24-20-7-8-21(22)19(16-20)15-18-10-13-23(14-11-18)12-9-17-5-3-2-4-6-17/h2-8,16,18H,9-15H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50460158 (CHEMBL4228366) Show SMILES COCCOc1cc(CC2CCN(CCc3ccc4OCCC(=O)c4c3)CC2)ccc1F Show InChI InChI=1S/C26H32FNO4/c1-30-14-15-32-26-18-21(2-4-23(26)27)16-20-7-11-28(12-8-20)10-6-19-3-5-25-22(17-19)24(29)9-13-31-25/h2-5,17-18,20H,6-16H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cell membranes after 30 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50460150 (CHEMBL4227376) Show SMILES COCCOc1cccc(CC2CCN(CCc3ccc4OCCC(=O)c4c3)CC2)c1 Show InChI InChI=1S/C26H33NO4/c1-29-15-16-30-23-4-2-3-22(18-23)17-21-8-12-27(13-9-21)11-7-20-5-6-26-24(19-20)25(28)10-14-31-26/h2-6,18-19,21H,7-17H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cell membranes after 30 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50460154 (CHEMBL4227238) Show SMILES COCCOc1cc(CC2CCN(CCc3ccc4OCCOc4c3)CC2)ccc1Br Show InChI InChI=1S/C25H32BrNO4/c1-28-12-13-30-24-18-21(2-4-22(24)26)16-20-7-10-27(11-8-20)9-6-19-3-5-23-25(17-19)31-15-14-29-23/h2-5,17-18,20H,6-16H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-citalopram from human SERT expressed in HEK293 cell membranes after 60 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50460143 (CHEMBL4227642) Show SMILES COCCOc1cc(CC2CCN(CCc3ccc4OCCS(=O)(=O)c4c3)CC2)ccc1Br Show InChI InChI=1S/C25H32BrNO5S/c1-30-12-13-31-24-17-21(2-4-22(24)26)16-20-7-10-27(11-8-20)9-6-19-3-5-23-25(18-19)33(28,29)15-14-32-23/h2-5,17-18,20H,6-16H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-citalopram from human SERT expressed in HEK293 cell membranes after 60 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206764 (CHEMBL3913541) Show SMILES COc1ccc(Br)c(CC2CCN(CCc3ccccc3)CC2)c1 Show InChI InChI=1S/C21H26BrNO/c1-24-20-7-8-21(22)19(16-20)15-18-10-13-23(14-11-18)12-9-17-5-3-2-4-6-17/h2-8,16,18H,9-15H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50460151 (CHEMBL4228158) Show SMILES COCCOc1cc(CC2CCN(CCc3ccc4OCCC(=O)c4c3)CC2)ccc1Cl Show InChI InChI=1S/C26H32ClNO4/c1-30-14-15-32-26-18-21(2-4-23(26)27)16-20-7-11-28(12-8-20)10-6-19-3-5-25-22(17-19)24(29)9-13-31-25/h2-5,17-18,20H,6-16H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cell membranes after 30 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206776 (CHEMBL3896561) Show SMILES COc1ccc(Br)c(CC2CCN(CCc3cccc(Cl)c3)CC2)c1 Show InChI InChI=1S/C21H25BrClNO/c1-25-20-5-6-21(22)18(15-20)13-17-8-11-24(12-9-17)10-7-16-3-2-4-19(23)14-16/h2-6,14-15,17H,7-13H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206774 (CHEMBL3924225) Show SMILES COc1ccc(Br)c(CC2CCN(CCc3ccccc3OC)CC2)c1 Show InChI InChI=1S/C22H28BrNO2/c1-25-20-7-8-21(23)19(16-20)15-17-9-12-24(13-10-17)14-11-18-5-3-4-6-22(18)26-2/h3-8,16-17H,9-15H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50460151 (CHEMBL4228158) Show SMILES COCCOc1cc(CC2CCN(CCc3ccc4OCCC(=O)c4c3)CC2)ccc1Cl Show InChI InChI=1S/C26H32ClNO4/c1-30-14-15-32-26-18-21(2-4-23(26)27)16-20-7-11-28(12-8-20)10-6-19-3-5-25-22(17-19)24(29)9-13-31-25/h2-5,17-18,20H,6-16H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-citalopram from human SERT expressed in HEK293 cell membranes after 60 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206784 (CHEMBL3913057) Show SMILES COc1ccc(Br)c(CC2CCN(CCc3ccccc3Cl)CC2)c1 Show InChI InChI=1S/C21H25BrClNO/c1-25-19-6-7-20(22)18(15-19)14-16-8-11-24(12-9-16)13-10-17-4-2-3-5-21(17)23/h2-7,15-16H,8-14H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206770 (CHEMBL3939995) Show SMILES COc1ccc(Br)c(CC2CCN(CCc3cccc4ccccc34)CC2)c1 Show InChI InChI=1S/C25H28BrNO/c1-28-23-9-10-25(26)22(18-23)17-19-11-14-27(15-12-19)16-13-21-7-4-6-20-5-2-3-8-24(20)21/h2-10,18-19H,11-17H2,1H3	PDB UniProtKB/SwissProt antibodypedia 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
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50460159 (CHEMBL4226281) Show SMILES COCCOc1cc(CC2CCN(CCc3ccc4OCCC(=O)c4c3)CC2)ccc1Br Show InChI InChI=1S/C26H32BrNO4/c1-30-14-15-32-26-18-21(2-4-23(26)27)16-20-7-11-28(12-8-20)10-6-19-3-5-25-22(17-19)24(29)9-13-31-25/h2-5,17-18,20H,6-16H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	5.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cell membranes after 30 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50460156 (CHEMBL4228218) Show SMILES COCCOc1cc(Br)cc(CC2CCN(CCc3ccc4OCCC(=O)c4c3)CC2)c1 Show InChI InChI=1S/C26H32BrNO4/c1-30-12-13-31-23-16-21(15-22(27)18-23)14-20-5-9-28(10-6-20)8-4-19-2-3-26-24(17-19)25(29)7-11-32-26/h2-3,15-18,20H,4-14H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	5.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-citalopram from human SERT expressed in HEK293 cell membranes after 60 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50460157 (CHEMBL4228775) Show SMILES COCCOc1cc(CC2CCN(CCc3ccc4OCCC(=O)c4c3)CC2)ccc1C Show InChI InChI=1S/C27H35NO4/c1-20-3-4-23(19-27(20)32-16-15-30-2)17-22-8-12-28(13-9-22)11-7-21-5-6-26-24(18-21)25(29)10-14-31-26/h3-6,18-19,22H,7-17H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	5.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-citalopram from human SERT expressed in HEK293 cell membranes after 60 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50460155 (CHEMBL4225176) Show SMILES COCCOc1cc(CC2CCN(CCc3ccc4CCCOc4c3)CC2)ccc1Br Show InChI InChI=1S/C26H34BrNO3/c1-29-15-16-31-26-19-22(5-7-24(26)27)17-21-9-12-28(13-10-21)11-8-20-4-6-23-3-2-14-30-25(23)18-20/h4-7,18-19,21H,2-3,8-17H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	5.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-citalopram from human SERT expressed in HEK293 cell membranes after 60 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50460144 (CHEMBL4228034) Show SMILES COCCOc1cc(CC2CCN(CCc3cc4OCCOc4cc3Cl)CC2)ccc1Br Show InChI InChI=1S/C25H31BrClNO4/c1-29-10-11-30-23-15-19(2-3-21(23)26)14-18-4-7-28(8-5-18)9-6-20-16-24-25(17-22(20)27)32-13-12-31-24/h2-3,15-18H,4-14H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	5.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-citalopram from human SERT expressed in HEK293 cell membranes after 60 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206760 (CHEMBL3892582) Show SMILES COc1ccc(F)c(CC2CCN(CCc3ccccc3)CC2)c1 Show InChI InChI=1S/C21H26FNO/c1-24-20-7-8-21(22)19(16-20)15-18-10-13-23(14-11-18)12-9-17-5-3-2-4-6-17/h2-8,16,18H,9-15H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206777 (CHEMBL3942269) Show SMILES COc1ccc(Br)c(CC2CCN(CCc3cc4OCCOc4cc3Cl)CC2)c1 Show InChI InChI=1S/C23H27BrClNO3/c1-27-19-2-3-20(24)18(13-19)12-16-4-7-26(8-5-16)9-6-17-14-22-23(15-21(17)25)29-11-10-28-22/h2-3,13-16H,4-12H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	6.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50460157 (CHEMBL4228775) Show SMILES COCCOc1cc(CC2CCN(CCc3ccc4OCCC(=O)c4c3)CC2)ccc1C Show InChI InChI=1S/C27H35NO4/c1-20-3-4-23(19-27(20)32-16-15-30-2)17-22-8-12-28(13-9-22)11-7-21-5-6-26-24(18-21)25(29)10-14-31-26/h3-6,18-19,22H,7-17H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	7.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cell membranes after 30 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50460162 (CHEMBL4229188) Show SMILES COCCOc1cc(CC2CCN(CCc3ccc4OCCC(O)c4c3)CC2)ccc1Br Show InChI InChI=1S/C26H34BrNO4/c1-30-14-15-32-26-18-21(2-4-23(26)27)16-20-7-11-28(12-8-20)10-6-19-3-5-25-22(17-19)24(29)9-13-31-25/h2-5,17-18,20,24,29H,6-16H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	8.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-citalopram from human SERT expressed in HEK293 cell membranes after 60 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50460160 (CHEMBL4229131) Show SMILES COCCOc1cc(CC2CCN(CCc3ccc4OCCC(=O)c4c3)CC2)ccc1I Show InChI InChI=1S/C26H32INO4/c1-30-14-15-32-26-18-21(2-4-23(26)27)16-20-7-11-28(12-8-20)10-6-19-3-5-25-22(17-19)24(29)9-13-31-25/h2-5,17-18,20H,6-16H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	8.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cell membranes after 30 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206765 (CHEMBL3906576) Show SMILES Cl.COCCOc1ccc(Br)c(CC2CCN(CCc3cc4OCCOc4cc3Cl)CC2)c1 Show InChI InChI=1S/C25H31BrClNO4/c1-29-10-11-30-21-2-3-22(26)20(15-21)14-18-4-7-28(8-5-18)9-6-19-16-24-25(17-23(19)27)32-13-12-31-24/h2-3,15-18H,4-14H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cells after 30 mins by liquid scintillation counting analysis				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50206765 (CHEMBL3906576) Show SMILES Cl.COCCOc1ccc(Br)c(CC2CCN(CCc3cc4OCCOc4cc3Cl)CC2)c1 Show InChI InChI=1S/C25H31BrClNO4/c1-29-10-11-30-21-2-3-22(26)20(15-21)14-18-4-7-28(8-5-18)9-6-19-16-24-25(17-23(19)27)32-13-12-31-24/h2-3,15-18H,4-14H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cell membranes after 30 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50460152 (CHEMBL4224788) Show SMILES CCc1ccc(CC2CCN(CCc3ccc4OCCC(=O)c4c3)CC2)cc1OCCOC Show InChI InChI=1S/C28H37NO4/c1-3-24-6-4-23(20-28(24)33-17-16-31-2)18-22-9-13-29(14-10-22)12-8-21-5-7-27-25(19-21)26(30)11-15-32-27/h4-7,19-20,22H,3,8-18H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	9.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-citalopram from human SERT expressed in HEK293 cell membranes after 60 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50460143 (CHEMBL4227642) Show SMILES COCCOc1cc(CC2CCN(CCc3ccc4OCCS(=O)(=O)c4c3)CC2)ccc1Br Show InChI InChI=1S/C25H32BrNO5S/c1-30-12-13-31-24-17-21(2-4-22(24)26)16-20-7-10-27(11-8-20)9-6-19-3-5-23-25(18-19)33(28,29)15-14-32-23/h2-5,17-18,20H,6-16H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cell membranes after 30 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50460148 (CHEMBL4226053) Show SMILES COCCOc1cc(CC2CCN(CCc3ccc4CCCC(=O)c4c3)CC2)ccc1Br Show InChI InChI=1S/C27H34BrNO3/c1-31-15-16-32-27-19-22(6-8-25(27)28)17-21-10-13-29(14-11-21)12-9-20-5-7-23-3-2-4-26(30)24(23)18-20/h5-8,18-19,21H,2-4,9-17H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from human 5-HT1A receptor expressed in CHOK1 cell membranes after 30 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50206777 (CHEMBL3942269) Show SMILES COc1ccc(Br)c(CC2CCN(CCc3cc4OCCOc4cc3Cl)CC2)c1 Show InChI InChI=1S/C23H27BrClNO3/c1-27-19-2-3-20(24)18(13-19)12-16-4-7-26(8-5-16)9-6-17-14-22-23(15-21(17)25)29-11-10-28-22/h2-3,13-16H,4-12H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of human SERT expressed in CHO cell membranes assessed as reduction in [3H]serotonin uptake preincubated for 10 mins followed by [3H]serot...				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50206758 (CHEMBL3898537) Show SMILES CC(C)Oc1ccc(Br)c(CC2CCN(CCc3cc4OCCOc4cc3Cl)CC2)c1 Show InChI InChI=1S/C25H31BrClNO3/c1-17(2)31-21-3-4-22(26)20(14-21)13-18-5-8-28(9-6-18)10-7-19-15-24-25(16-23(19)27)30-12-11-29-24/h3-4,14-18H,5-13H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of human SERT expressed in CHO cell membranes assessed as reduction in [3H]serotonin uptake preincubated for 10 mins followed by [3H]serot...				Bioorg Med Chem 25: 293-304 (2017) Article DOI: 10.1016/j.bmc.2016.10.034 BindingDB Entry DOI: 10.7270/Q2571F0B
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50460142 (CHEMBL4226603) Show SMILES COCCOc1cc(Br)cc(CC2CCN(CCc3cc4OCCOc4cc3Cl)CC2)c1 Show InChI InChI=1S/C25H31BrClNO4/c1-29-8-9-30-22-14-19(13-21(26)16-22)12-18-2-5-28(6-3-18)7-4-20-15-24-25(17-23(20)27)32-11-10-31-24/h13-18H,2-12H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Dainippon Pharma CO., Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]-citalopram from human SERT expressed in HEK293 cell membranes after 60 mins by liquid scintillation counting				Bioorg Med Chem 26: 1614-1627 (2018) Article DOI: 10.1016/j.bmc.2018.02.008 BindingDB Entry DOI: 10.7270/Q2CN76HF
					More data for this Ligand-Target Pair

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