BindingDB logo
myBDB logout

PubMed code 14592479

Compile data set for download or QSAR
Found 60 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135254
PNG
((S)-1-(1H-Indol-4-yloxy)-3-[(1S,3R,5R)-3-(4-methox...)
Show SMILES COc1cccc2sc(cc12)[C@@H]1C[C@@H]2CC[C@H](C1)N2C[C@H](O)COc1cccc2[nH]ccc12
Show InChI InChI=1S/C27H30N2O3S/c1-31-24-5-3-7-26-22(24)14-27(33-26)17-12-18-8-9-19(13-17)29(18)15-20(30)16-32-25-6-2-4-23-21(25)10-11-28-23/h2-7,10-11,14,17-20,28,30H,8-9,12-13,15-16H2,1H3/t17-,18+,19-,20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.170n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135249
PNG
((S)-1-((2S,4R)-4-(5-fluorobenzo[b]thiophen-2-yl)-2...)
Show SMILES C[C@H]1C[C@@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2cc(F)ccc2s1
Show InChI InChI=1S/C26H29FN2O2S/c1-16-10-22-23(28-16)4-3-5-24(22)31-15-21(30)14-29-9-8-18(11-17(29)2)26-13-19-12-20(27)6-7-25(19)32-26/h3-7,10,12-13,17-18,21,28,30H,8-9,11,14-15H2,1-2H3/t17-,18+,21-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
0.240n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135248
PNG
(4-{(S)-2-Hydroxy-3-[(1R,3S,5S)-3-(4-methoxy-benzo[...)
Show SMILES COc1cccc2sc(cc12)[C@H]1C[C@@H]2CC[C@H](C1)N2C[C@H](O)COc1cccc2[nH]c(cc12)C(N)=O
Show InChI InChI=1S/C28H31N3O4S/c1-34-24-5-3-7-26-21(24)13-27(36-26)16-10-17-8-9-18(11-16)31(17)14-19(32)15-35-25-6-2-4-22-20(25)12-23(30-22)28(29)33/h2-7,12-13,16-19,30,32H,8-11,14-15H2,1H3,(H2,29,33)/t16-,17-,18+,19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.370n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135244
PNG
((S)-1-[(2S,4R)-4-(6-Fluoro-benzo[b]thiophen-2-yl)-...)
Show SMILES C[C@H]1C[C@@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2ccc(F)cc2s1
Show InChI InChI=1S/C26H29FN2O2S/c1-16-10-22-23(28-16)4-3-5-24(22)31-15-21(30)14-29-9-8-19(11-17(29)2)25-12-18-6-7-20(27)13-26(18)32-25/h3-7,10,12-13,17,19,21,28,30H,8-9,11,14-15H2,1-2H3/t17-,19+,21-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
0.390n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135253
PNG
((S)-1-[(1S,3R,5R)-3-(4-Methoxy-benzo[b]thiophen-2-...)
Show SMILES COc1cccc2sc(cc12)[C@@H]1C[C@@H]2CC[C@H](C1)N2C[C@H](O)COc1cccc2[nH]c(C)cc12
Show InChI InChI=1S/C28H32N2O3S/c1-17-11-22-24(29-17)5-3-7-26(22)33-16-21(31)15-30-19-9-10-20(30)13-18(12-19)28-14-23-25(32-2)6-4-8-27(23)34-28/h3-8,11,14,18-21,29,31H,9-10,12-13,15-16H2,1-2H3/t18-,19+,20-,21-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.450n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135246
PNG
((S)-1-((2S,4R)-4-(benzo[b]thiophen-2-yl)-2-methylp...)
Show SMILES C[C@H]1C[C@@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2ccccc2s1
Show InChI InChI=1S/C26H30N2O2S/c1-17-12-22-23(27-17)7-5-8-24(22)30-16-21(29)15-28-11-10-20(13-18(28)2)26-14-19-6-3-4-9-25(19)31-26/h3-9,12,14,18,20-21,27,29H,10-11,13,15-16H2,1-2H3/t18-,20+,21-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.530n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135263
PNG
(4-{(S)-2-Hydroxy-3-[(2S,4R)-4-(4-methoxy-benzo[b]t...)
Show SMILES COc1cccc2sc(cc12)[C@@H]1CCN(C[C@H](O)COc2cccc3[nH]c(cc23)C(N)=O)[C@@H](C)C1
Show InChI InChI=1S/C27H31N3O4S/c1-16-11-17(26-13-20-23(33-2)6-4-8-25(20)35-26)9-10-30(16)14-18(31)15-34-24-7-3-5-21-19(24)12-22(29-21)27(28)32/h3-8,12-13,16-18,29,31H,9-11,14-15H2,1-2H3,(H2,28,32)/t16-,17+,18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
0.560n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135238
PNG
((S)-1-(2-Methyl-1H-indol-4-yloxy)-3-[(2S,4R)-2-met...)
Show SMILES C[C@H]1C[C@@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2c(C)cccc2s1
Show InChI InChI=1S/C27H32N2O2S/c1-17-6-4-9-26-22(17)14-27(32-26)20-10-11-29(19(3)13-20)15-21(30)16-31-25-8-5-7-24-23(25)12-18(2)28-24/h4-9,12,14,19-21,28,30H,10-11,13,15-16H2,1-3H3/t19-,20+,21-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
0.620n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135266
PNG
((S)-1-[(1R,3S,5S)-3-(4-Methoxy-benzo[b]thiophen-2-...)
Show SMILES COc1cccc2sc(cc12)[C@H]1C[C@@H]2CC[C@H](C1)N2C[C@H](O)COc1cccc2[nH]c(C)cc12
Show InChI InChI=1S/C28H32N2O3S/c1-17-11-22-24(29-17)5-3-7-26(22)33-16-21(31)15-30-19-9-10-20(30)13-18(12-19)28-14-23-25(32-2)6-4-8-27(23)34-28/h3-8,11,14,18-21,29,31H,9-10,12-13,15-16H2,1-2H3/t18-,19-,20+,21-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.690n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135265
PNG
((S)-1-[(2S,4R)-4-(4-Fluoro-benzo[b]thiophen-2-yl)-...)
Show SMILES C[C@H]1C[C@@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2c(F)cccc2s1
Show InChI InChI=1S/C26H29FN2O2S/c1-16-11-21-23(28-16)6-4-7-24(21)31-15-19(30)14-29-10-9-18(12-17(29)2)26-13-20-22(27)5-3-8-25(20)32-26/h3-8,11,13,17-19,28,30H,9-10,12,14-15H2,1-2H3/t17-,18+,19-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.75n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135256
PNG
((S)-1-((2S,4R)-4-(4-methoxybenzo[b]thiophen-2-yl)-...)
Show SMILES COc1cccc2sc(cc12)[C@@H]1CCN(C[C@H](O)COc2cccc3[nH]c(C)cc23)[C@@H](C)C1
Show InChI InChI=1S/C27H32N2O3S/c1-17-12-21-23(28-17)6-4-8-25(21)32-16-20(30)15-29-11-10-19(13-18(29)2)27-14-22-24(31-3)7-5-9-26(22)33-27/h4-9,12,14,18-20,28,30H,10-11,13,15-16H2,1-3H3/t18-,19+,20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
0.860n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135265
PNG
((S)-1-[(2S,4R)-4-(4-Fluoro-benzo[b]thiophen-2-yl)-...)
Show SMILES C[C@H]1C[C@@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2c(F)cccc2s1
Show InChI InChI=1S/C26H29FN2O2S/c1-16-11-21-23(28-16)6-4-7-24(21)31-15-19(30)14-29-10-9-18(12-17(29)2)26-13-20-22(27)5-3-8-25(20)32-26/h3-8,11,13,17-19,28,30H,9-10,12,14-15H2,1-2H3/t17-,18+,19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.920n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135242
PNG
((S)-1-[(2S,4R)-4-(5-Chloro-benzo[b]thiophen-2-yl)-...)
Show SMILES C[C@H]1C[C@@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2cc(Cl)ccc2s1
Show InChI InChI=1S/C26H29ClN2O2S/c1-16-10-22-23(28-16)4-3-5-24(22)31-15-21(30)14-29-9-8-18(11-17(29)2)26-13-19-12-20(27)6-7-25(19)32-26/h3-7,10,12-13,17-18,21,28,30H,8-9,11,14-15H2,1-2H3/t17-,18+,21-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
1n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135259
PNG
(4-{(S)-2-Hydroxy-3-[(2R,4S)-4-(4-methoxy-benzo[b]t...)
Show SMILES COc1cccc2sc(cc12)[C@H]1CCN(C[C@H](O)COc2cccc3[nH]c(cc23)C(N)=O)[C@H](C)C1
Show InChI InChI=1S/C27H31N3O4S/c1-16-11-17(26-13-20-23(33-2)6-4-8-25(20)35-26)9-10-30(16)14-18(31)15-34-24-7-3-5-21-19(24)12-22(29-21)27(28)32/h3-8,12-13,16-18,29,31H,9-11,14-15H2,1-2H3,(H2,28,32)/t16-,17+,18+/m1/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
1.20n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135237
PNG
((S)-1-(2-Methyl-1H-indol-4-yloxy)-3-[(2S,4R)-2-met...)
Show SMILES C[C@H]1C[C@@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2ccc(C)cc2s1
Show InChI InChI=1S/C27H32N2O2S/c1-17-7-8-20-14-27(32-26(20)11-17)21-9-10-29(19(3)13-21)15-22(30)16-31-25-6-4-5-24-23(25)12-18(2)28-24/h4-8,11-12,14,19,21-22,28,30H,9-10,13,15-16H2,1-3H3/t19-,21+,22-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
1.30n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135255
PNG
((S)-1-[(2S,4R)-4-(7-Fluoro-benzo[b]thiophen-2-yl)-...)
Show SMILES C[C@H]1C[C@@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2cccc(F)c2s1
Show InChI InChI=1S/C26H29FN2O2S/c1-16-11-21-23(28-16)7-4-8-24(21)31-15-20(30)14-29-10-9-18(12-17(29)2)25-13-19-5-3-6-22(27)26(19)32-25/h3-8,11,13,17-18,20,28,30H,9-10,12,14-15H2,1-2H3/t17-,18+,20-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
1.30n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135255
PNG
((S)-1-[(2S,4R)-4-(7-Fluoro-benzo[b]thiophen-2-yl)-...)
Show SMILES C[C@H]1C[C@@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2cccc(F)c2s1
Show InChI InChI=1S/C26H29FN2O2S/c1-16-11-21-23(28-16)7-4-8-24(21)31-15-20(30)14-29-10-9-18(12-17(29)2)25-13-19-5-3-6-22(27)26(19)32-25/h3-8,11,13,17-18,20,28,30H,9-10,12,14-15H2,1-2H3/t17-,18+,20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
1.30n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50130170
PNG
((S)-1-(1H-Indol-4-yloxy)-3-[(1R,3S,5S)-3-(4-methox...)
Show SMILES COc1cccc2sc(cc12)[C@H]1C[C@@H]2CC[C@H](C1)N2C[C@H](O)COc1cccc2[nH]ccc12
Show InChI InChI=1S/C27H30N2O3S/c1-31-24-5-3-7-26-22(24)14-27(33-26)17-12-18-8-9-19(13-17)29(18)15-20(30)16-32-25-6-2-4-23-21(25)10-11-28-23/h2-7,10-11,14,17-20,28,30H,8-9,12-13,15-16H2,1H3/t17-,18-,19+,20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.30n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135251
PNG
((S)-1-[(2S,4R)-4-(4,6-Dimethyl-benzo[b]thiophen-2-...)
Show SMILES C[C@H]1C[C@@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2c(C)cc(C)cc2s1
Show InChI InChI=1S/C28H34N2O2S/c1-17-10-18(2)23-14-27(33-28(23)11-17)21-8-9-30(20(4)13-21)15-22(31)16-32-26-7-5-6-25-24(26)12-19(3)29-25/h5-7,10-12,14,20-22,29,31H,8-9,13,15-16H2,1-4H3/t20-,21+,22-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
2n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135257
PNG
((S)-1-[(2R,4R)-4-(7-Fluoro-benzo[b]thiophen-2-yl)-...)
Show SMILES C[C@@H]1C[C@@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2cccc(F)c2s1
Show InChI InChI=1S/C26H29FN2O2S/c1-16-11-21-23(28-16)7-4-8-24(21)31-15-20(30)14-29-10-9-18(12-17(29)2)25-13-19-5-3-6-22(27)26(19)32-25/h3-8,11,13,17-18,20,28,30H,9-10,12,14-15H2,1-2H3/t17-,18-,20+/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
2.10n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135261
PNG
((S)-1-[(2S,4R)-4-(6-Methoxy-benzo[b]thiophen-2-yl)...)
Show SMILES COc1ccc2cc(sc2c1)[C@@H]1CCN(C[C@H](O)COc2cccc3[nH]c(C)cc23)[C@@H](C)C1
Show InChI InChI=1S/C27H32N2O3S/c1-17-11-23-24(28-17)5-4-6-25(23)32-16-21(30)15-29-10-9-20(12-18(29)2)26-13-19-7-8-22(31-3)14-27(19)33-26/h4-8,11,13-14,18,20-21,28,30H,9-10,12,15-16H2,1-3H3/t18-,20+,21-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
2.40n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135247
PNG
((S)-1-[(2S,4R)-4-(4,6-Dimethoxy-benzo[b]thiophen-2...)
Show SMILES COc1cc(OC)c2cc(sc2c1)[C@@H]1CCN(C[C@H](O)COc2cccc3[nH]c(C)cc23)[C@@H](C)C1
Show InChI InChI=1S/C28H34N2O4S/c1-17-10-22-24(29-17)6-5-7-25(22)34-16-20(31)15-30-9-8-19(11-18(30)2)27-14-23-26(33-4)12-21(32-3)13-28(23)35-27/h5-7,10,12-14,18-20,29,31H,8-9,11,15-16H2,1-4H3/t18-,19+,20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
2.80n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135239
PNG
((S)-1-[(2R,4S)-4-(4-Methoxy-benzo[b]thiophen-2-yl)...)
Show SMILES COc1cccc2sc(cc12)[C@H]1CCN(C[C@H](O)COc2cccc3[nH]c(C)cc23)[C@H](C)C1
Show InChI InChI=1S/C27H32N2O3S/c1-17-12-21-23(28-17)6-4-8-25(21)32-16-20(30)15-29-11-10-19(13-18(29)2)27-14-22-24(31-3)7-5-9-26(22)33-27/h4-9,12,14,18-20,28,30H,10-11,13,15-16H2,1-3H3/t18-,19+,20+/m1/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
3.30n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135258
PNG
((S)-1-[(2S,4R)-4-(4-Methoxy-benzo[b]thiophen-2-yl)...)
Show SMILES COc1cccc2sc(cc12)[C@@H]1CCN(C[C@H](O)COc2cccc3oc(C)cc23)[C@@H](C)C1
Show InChI InChI=1S/C27H31NO4S/c1-17-12-19(27-14-22-23(30-3)6-5-9-26(22)33-27)10-11-28(17)15-20(29)16-31-24-7-4-8-25-21(24)13-18(2)32-25/h4-9,13-14,17,19-20,29H,10-12,15-16H2,1-3H3/t17-,19+,20-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
4.10n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135245
PNG
((S)-1-[(2R,4R)-4-(4-Methoxy-benzo[b]thiophen-2-yl)...)
Show SMILES COc1cccc2sc(cc12)[C@@H]1CCN(C[C@H](O)COc2cccc3oc(C)cc23)[C@H](C)C1
Show InChI InChI=1S/C27H31NO4S/c1-17-12-19(27-14-22-23(30-3)6-5-9-26(22)33-27)10-11-28(17)15-20(29)16-31-24-7-4-8-25-21(24)13-18(2)32-25/h4-9,13-14,17,19-20,29H,10-12,15-16H2,1-3H3/t17-,19-,20+/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
4.80n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135249
PNG
((S)-1-((2S,4R)-4-(5-fluorobenzo[b]thiophen-2-yl)-2...)
Show SMILES C[C@H]1C[C@@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2cc(F)ccc2s1
Show InChI InChI=1S/C26H29FN2O2S/c1-16-10-22-23(28-16)4-3-5-24(22)31-15-21(30)14-29-9-8-18(11-17(29)2)26-13-19-12-20(27)6-7-25(19)32-26/h3-7,10,12-13,17-18,21,28,30H,8-9,11,14-15H2,1-2H3/t17-,18+,21-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
5.70n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135241
PNG
((S)-1-[(2R,4S)-4-(7-Fluoro-benzo[b]thiophen-2-yl)-...)
Show SMILES C[C@@H]1C[C@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2cccc(F)c2s1
Show InChI InChI=1S/C26H29FN2O2S/c1-16-11-21-23(28-16)7-4-8-24(21)31-15-20(30)14-29-10-9-18(12-17(29)2)25-13-19-5-3-6-22(27)26(19)32-25/h3-8,11,13,17-18,20,28,30H,9-10,12,14-15H2,1-2H3/t17-,18+,20+/m1/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
6.10n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135263
PNG
(4-{(S)-2-Hydroxy-3-[(2S,4R)-4-(4-methoxy-benzo[b]t...)
Show SMILES COc1cccc2sc(cc12)[C@@H]1CCN(C[C@H](O)COc2cccc3[nH]c(cc23)C(N)=O)[C@@H](C)C1
Show InChI InChI=1S/C27H31N3O4S/c1-16-11-17(26-13-20-23(33-2)6-4-8-25(20)35-26)9-10-30(16)14-18(31)15-34-24-7-3-5-21-19(24)12-22(29-21)27(28)32/h3-8,12-13,16-18,29,31H,9-11,14-15H2,1-2H3,(H2,28,32)/t16-,17+,18-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
6.40n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135252
PNG
(4-{(S)-2-Hydroxy-3-[(2S,4S)-4-(4-methoxy-benzo[b]t...)
Show SMILES COc1cccc2sc(cc12)[C@H]1CCN(C[C@H](O)COc2cccc3[nH]c(cc23)C(N)=O)[C@@H](C)C1
Show InChI InChI=1S/C27H31N3O4S/c1-16-11-17(26-13-20-23(33-2)6-4-8-25(20)35-26)9-10-30(16)14-18(31)15-34-24-7-3-5-21-19(24)12-22(29-21)27(28)32/h3-8,12-13,16-18,29,31H,9-11,14-15H2,1-2H3,(H2,28,32)/t16-,17-,18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
6.60n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135246
PNG
((S)-1-((2S,4R)-4-(benzo[b]thiophen-2-yl)-2-methylp...)
Show SMILES C[C@H]1C[C@@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2ccccc2s1
Show InChI InChI=1S/C26H30N2O2S/c1-17-12-22-23(27-17)7-5-8-24(22)30-16-21(29)15-28-11-10-20(13-18(28)2)26-14-19-6-3-4-9-25(19)31-26/h3-9,12,14,18,20-21,27,29H,10-11,13,15-16H2,1-2H3/t18-,20+,21-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
7.10n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135266
PNG
((S)-1-[(1R,3S,5S)-3-(4-Methoxy-benzo[b]thiophen-2-...)
Show SMILES COc1cccc2sc(cc12)[C@H]1C[C@@H]2CC[C@H](C1)N2C[C@H](O)COc1cccc2[nH]c(C)cc12
Show InChI InChI=1S/C28H32N2O3S/c1-17-11-22-24(29-17)5-3-7-26(22)33-16-21(31)15-30-19-9-10-20(30)13-18(12-19)28-14-23-25(32-2)6-4-8-27(23)34-28/h3-8,11,14,18-21,29,31H,9-10,12-13,15-16H2,1-2H3/t18-,19-,20+,21-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
9.20n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135240
PNG
((S)-1-[4-(4-Methoxy-benzo[b]thiophen-2-yl)-2,2-dim...)
Show SMILES COc1cccc2sc(cc12)C1CCN(C[C@H](O)COc2cccc3[nH]c(C)cc23)C(C)(C)C1
Show InChI InChI=1S/C28H34N2O3S/c1-18-13-21-23(29-18)7-5-9-25(21)33-17-20(31)16-30-12-11-19(15-28(30,2)3)27-14-22-24(32-4)8-6-10-26(22)34-27/h5-10,13-14,19-20,29,31H,11-12,15-17H2,1-4H3/t19?,20-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
9.40n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135241
PNG
((S)-1-[(2R,4S)-4-(7-Fluoro-benzo[b]thiophen-2-yl)-...)
Show SMILES C[C@@H]1C[C@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2cccc(F)c2s1
Show InChI InChI=1S/C26H29FN2O2S/c1-16-11-21-23(28-16)7-4-8-24(21)31-15-20(30)14-29-10-9-18(12-17(29)2)25-13-19-5-3-6-22(27)26(19)32-25/h3-8,11,13,17-18,20,28,30H,9-10,12,14-15H2,1-2H3/t17-,18+,20+/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
9.80n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135238
PNG
((S)-1-(2-Methyl-1H-indol-4-yloxy)-3-[(2S,4R)-2-met...)
Show SMILES C[C@H]1C[C@@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2c(C)cccc2s1
Show InChI InChI=1S/C27H32N2O2S/c1-17-6-4-9-26-22(17)14-27(32-26)20-10-11-29(19(3)13-20)15-21(30)16-31-25-8-5-7-24-23(25)12-18(2)28-24/h4-9,12,14,19-21,28,30H,10-11,13,15-16H2,1-3H3/t19-,20+,21-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
11n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135244
PNG
((S)-1-[(2S,4R)-4-(6-Fluoro-benzo[b]thiophen-2-yl)-...)
Show SMILES C[C@H]1C[C@@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2ccc(F)cc2s1
Show InChI InChI=1S/C26H29FN2O2S/c1-16-10-22-23(28-16)4-3-5-24(22)31-15-21(30)14-29-9-8-19(11-17(29)2)25-12-18-6-7-20(27)13-26(18)32-25/h3-7,10,12-13,17,19,21,28,30H,8-9,11,14-15H2,1-2H3/t17-,19+,21-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
12n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135248
PNG
(4-{(S)-2-Hydroxy-3-[(1R,3S,5S)-3-(4-methoxy-benzo[...)
Show SMILES COc1cccc2sc(cc12)[C@H]1C[C@@H]2CC[C@H](C1)N2C[C@H](O)COc1cccc2[nH]c(cc12)C(N)=O
Show InChI InChI=1S/C28H31N3O4S/c1-34-24-5-3-7-26-21(24)13-27(36-26)16-10-17-8-9-18(11-16)31(17)14-19(32)15-35-25-6-2-4-22-20(25)12-23(30-22)28(29)33/h2-7,12-13,16-19,30,32H,8-11,14-15H2,1H3,(H2,29,33)/t16-,17-,18+,19-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
12n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135261
PNG
((S)-1-[(2S,4R)-4-(6-Methoxy-benzo[b]thiophen-2-yl)...)
Show SMILES COc1ccc2cc(sc2c1)[C@@H]1CCN(C[C@H](O)COc2cccc3[nH]c(C)cc23)[C@@H](C)C1
Show InChI InChI=1S/C27H32N2O3S/c1-17-11-23-24(28-17)5-4-6-25(23)32-16-21(30)15-29-10-9-20(12-18(29)2)26-13-19-7-8-22(31-3)14-27(19)33-26/h4-8,11,13-14,18,20-21,28,30H,9-10,12,15-16H2,1-3H3/t18-,20+,21-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
13n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135264
PNG
(4-{(S)-2-Hydroxy-3-[(2R,4R)-4-(4-methoxy-benzo[b]t...)
Show SMILES COc1cccc2sc(cc12)[C@@H]1CCN(C[C@H](O)COc2cccc3[nH]c(cc23)C(N)=O)[C@H](C)C1
Show InChI InChI=1S/C27H31N3O4S/c1-16-11-17(26-13-20-23(33-2)6-4-8-25(20)35-26)9-10-30(16)14-18(31)15-34-24-7-3-5-21-19(24)12-22(29-21)27(28)32/h3-8,12-13,16-18,29,31H,9-11,14-15H2,1-2H3,(H2,28,32)/t16-,17-,18+/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
13n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135256
PNG
((S)-1-((2S,4R)-4-(4-methoxybenzo[b]thiophen-2-yl)-...)
Show SMILES COc1cccc2sc(cc12)[C@@H]1CCN(C[C@H](O)COc2cccc3[nH]c(C)cc23)[C@@H](C)C1
Show InChI InChI=1S/C27H32N2O3S/c1-17-12-21-23(28-17)6-4-8-25(21)32-16-20(30)15-29-11-10-19(13-18(29)2)27-14-22-24(31-3)7-5-9-26(22)33-27/h4-9,12,14,18-20,28,30H,10-11,13,15-16H2,1-3H3/t18-,19+,20-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
14n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135250
PNG
((S)-1-[(2R,4S)-4-(4-Methoxy-benzo[b]thiophen-2-yl)...)
Show SMILES COc1cccc2sc(cc12)[C@H]1CCN(C[C@H](O)COc2cccc3oc(C)cc23)[C@H](C)C1
Show InChI InChI=1S/C27H31NO4S/c1-17-12-19(27-14-22-23(30-3)6-5-9-26(22)33-27)10-11-28(17)15-20(29)16-31-24-7-4-8-25-21(24)13-18(2)32-25/h4-9,13-14,17,19-20,29H,10-12,15-16H2,1-3H3/t17-,19+,20+/m1/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
15n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135242
PNG
((S)-1-[(2S,4R)-4-(5-Chloro-benzo[b]thiophen-2-yl)-...)
Show SMILES C[C@H]1C[C@@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2cc(Cl)ccc2s1
Show InChI InChI=1S/C26H29ClN2O2S/c1-16-10-22-23(28-16)4-3-5-24(22)31-15-21(30)14-29-9-8-18(11-17(29)2)26-13-19-12-20(27)6-7-25(19)32-26/h3-7,10,12-13,17-18,21,28,30H,8-9,11,14-15H2,1-2H3/t17-,18+,21-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
16n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50130170
PNG
((S)-1-(1H-Indol-4-yloxy)-3-[(1R,3S,5S)-3-(4-methox...)
Show SMILES COc1cccc2sc(cc12)[C@H]1C[C@@H]2CC[C@H](C1)N2C[C@H](O)COc1cccc2[nH]ccc12
Show InChI InChI=1S/C27H30N2O3S/c1-31-24-5-3-7-26-22(24)14-27(33-26)17-12-18-8-9-19(13-17)29(18)15-20(30)16-32-25-6-2-4-23-21(25)10-11-28-23/h2-7,10-11,14,17-20,28,30H,8-9,12-13,15-16H2,1H3/t17-,18-,19+,20-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
16n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135264
PNG
(4-{(S)-2-Hydroxy-3-[(2R,4R)-4-(4-methoxy-benzo[b]t...)
Show SMILES COc1cccc2sc(cc12)[C@@H]1CCN(C[C@H](O)COc2cccc3[nH]c(cc23)C(N)=O)[C@H](C)C1
Show InChI InChI=1S/C27H31N3O4S/c1-16-11-17(26-13-20-23(33-2)6-4-8-25(20)35-26)9-10-30(16)14-18(31)15-34-24-7-3-5-21-19(24)12-22(29-21)27(28)32/h3-8,12-13,16-18,29,31H,9-11,14-15H2,1-2H3,(H2,28,32)/t16-,17-,18+/m1/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
16n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135243
PNG
((S)-1-[(2S,4S)-4-(7-Fluoro-benzo[b]thiophen-2-yl)-...)
Show SMILES C[C@H]1C[C@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2cccc(F)c2s1
Show InChI InChI=1S/C26H29FN2O2S/c1-16-11-21-23(28-16)7-4-8-24(21)31-15-20(30)14-29-10-9-18(12-17(29)2)25-13-19-5-3-6-22(27)26(19)32-25/h3-8,11,13,17-18,20,28,30H,9-10,12,14-15H2,1-2H3/t17-,18-,20-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
19n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135260
PNG
((S)-1-[(2R,4R)-4-(4-Methoxy-benzo[b]thiophen-2-yl)...)
Show SMILES COc1cccc2sc(cc12)[C@@H]1CCN(C[C@H](O)COc2cccc3[nH]c(C)cc23)[C@H](C)C1
Show InChI InChI=1S/C27H32N2O3S/c1-17-12-21-23(28-17)6-4-8-25(21)32-16-20(30)15-29-11-10-19(13-18(29)2)27-14-22-24(31-3)7-5-9-26(22)33-27/h4-9,12,14,18-20,28,30H,10-11,13,15-16H2,1-3H3/t18-,19-,20+/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
20n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135253
PNG
((S)-1-[(1S,3R,5R)-3-(4-Methoxy-benzo[b]thiophen-2-...)
Show SMILES COc1cccc2sc(cc12)[C@@H]1C[C@@H]2CC[C@H](C1)N2C[C@H](O)COc1cccc2[nH]c(C)cc12
Show InChI InChI=1S/C28H32N2O3S/c1-17-11-22-24(29-17)5-3-7-26(22)33-16-21(31)15-30-19-9-10-20(30)13-18(12-19)28-14-23-25(32-2)6-4-8-27(23)34-28/h3-8,11,14,18-21,29,31H,9-10,12-13,15-16H2,1-2H3/t18-,19+,20-,21-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
21n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135240
PNG
((S)-1-[4-(4-Methoxy-benzo[b]thiophen-2-yl)-2,2-dim...)
Show SMILES COc1cccc2sc(cc12)C1CCN(C[C@H](O)COc2cccc3[nH]c(C)cc23)C(C)(C)C1
Show InChI InChI=1S/C28H34N2O3S/c1-18-13-21-23(29-18)7-5-9-25(21)33-17-20(31)16-30-12-11-19(15-28(30,2)3)27-14-22-24(32-4)8-6-10-26(22)34-27/h5-10,13-14,19-20,29,31H,11-12,15-17H2,1-4H3/t19?,20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
21n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135247
PNG
((S)-1-[(2S,4R)-4-(4,6-Dimethoxy-benzo[b]thiophen-2...)
Show SMILES COc1cc(OC)c2cc(sc2c1)[C@@H]1CCN(C[C@H](O)COc2cccc3[nH]c(C)cc23)[C@@H](C)C1
Show InChI InChI=1S/C28H34N2O4S/c1-17-10-22-24(29-17)6-5-7-25(22)34-16-20(31)15-30-9-8-19(11-18(30)2)27-14-23-26(33-4)12-21(32-3)13-28(23)35-27/h5-7,10,12-14,18-20,29,31H,8-9,11,15-16H2,1-4H3/t18-,19+,20-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
23n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135250
PNG
((S)-1-[(2R,4S)-4-(4-Methoxy-benzo[b]thiophen-2-yl)...)
Show SMILES COc1cccc2sc(cc12)[C@H]1CCN(C[C@H](O)COc2cccc3oc(C)cc23)[C@H](C)C1
Show InChI InChI=1S/C27H31NO4S/c1-17-12-19(27-14-22-23(30-3)6-5-9-26(22)33-27)10-11-28(17)15-20(29)16-31-24-7-4-8-25-21(24)13-18(2)32-25/h4-9,13-14,17,19-20,29H,10-12,15-16H2,1-3H3/t17-,19+,20+/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
27n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135239
PNG
((S)-1-[(2R,4S)-4-(4-Methoxy-benzo[b]thiophen-2-yl)...)
Show SMILES COc1cccc2sc(cc12)[C@H]1CCN(C[C@H](O)COc2cccc3[nH]c(C)cc23)[C@H](C)C1
Show InChI InChI=1S/C27H32N2O3S/c1-17-12-21-23(28-17)6-4-8-25(21)32-16-20(30)15-29-11-10-19(13-18(29)2)27-14-22-24(31-3)7-5-9-26(22)33-27/h4-9,12,14,18-20,28,30H,10-11,13,15-16H2,1-3H3/t18-,19+,20+/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
28n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135260
PNG
((S)-1-[(2R,4R)-4-(4-Methoxy-benzo[b]thiophen-2-yl)...)
Show SMILES COc1cccc2sc(cc12)[C@@H]1CCN(C[C@H](O)COc2cccc3[nH]c(C)cc23)[C@H](C)C1
Show InChI InChI=1S/C27H32N2O3S/c1-17-12-21-23(28-17)6-4-8-25(21)32-16-20(30)15-29-11-10-19(13-18(29)2)27-14-22-24(31-3)7-5-9-26(22)33-27/h4-9,12,14,18-20,28,30H,10-11,13,15-16H2,1-3H3/t18-,19-,20+/m1/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
29n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135259
PNG
(4-{(S)-2-Hydroxy-3-[(2R,4S)-4-(4-methoxy-benzo[b]t...)
Show SMILES COc1cccc2sc(cc12)[C@H]1CCN(C[C@H](O)COc2cccc3[nH]c(cc23)C(N)=O)[C@H](C)C1
Show InChI InChI=1S/C27H31N3O4S/c1-16-11-17(26-13-20-23(33-2)6-4-8-25(20)35-26)9-10-30(16)14-18(31)15-34-24-7-3-5-21-19(24)12-22(29-21)27(28)32/h3-8,12-13,16-18,29,31H,9-11,14-15H2,1-2H3,(H2,28,32)/t16-,17+,18+/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
32n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135257
PNG
((S)-1-[(2R,4R)-4-(7-Fluoro-benzo[b]thiophen-2-yl)-...)
Show SMILES C[C@@H]1C[C@@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2cccc(F)c2s1
Show InChI InChI=1S/C26H29FN2O2S/c1-16-11-21-23(28-16)7-4-8-24(21)31-15-20(30)14-29-10-9-18(12-17(29)2)25-13-19-5-3-6-22(27)26(19)32-25/h3-8,11,13,17-18,20,28,30H,9-10,12,14-15H2,1-2H3/t17-,18-,20+/m1/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
34n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135258
PNG
((S)-1-[(2S,4R)-4-(4-Methoxy-benzo[b]thiophen-2-yl)...)
Show SMILES COc1cccc2sc(cc12)[C@@H]1CCN(C[C@H](O)COc2cccc3oc(C)cc23)[C@@H](C)C1
Show InChI InChI=1S/C27H31NO4S/c1-17-12-19(27-14-22-23(30-3)6-5-9-26(22)33-27)10-11-28(17)15-20(29)16-31-24-7-4-8-25-21(24)13-18(2)32-25/h4-9,13-14,17,19-20,29H,10-12,15-16H2,1-3H3/t17-,19+,20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
38n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Dopamine D2 receptor and serotonin 1a receptor


(Homo sapiens (human))
BDBM50135240
PNG
((S)-1-[4-(4-Methoxy-benzo[b]thiophen-2-yl)-2,2-dim...)
Show SMILES COc1cccc2sc(cc12)C1CCN(C[C@H](O)COc2cccc3[nH]c(C)cc23)C(C)(C)C1
Show InChI InChI=1S/C28H34N2O3S/c1-18-13-21-23(29-18)7-5-9-25(21)33-17-20(31)16-30-12-11-19(15-28(30,2)3)27-14-22-24(32-4)8-6-10-26(22)34-27/h5-10,13-14,19-20,29,31H,11-12,15-17H2,1-4H3/t19?,20-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
43n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135243
PNG
((S)-1-[(2S,4S)-4-(7-Fluoro-benzo[b]thiophen-2-yl)-...)
Show SMILES C[C@H]1C[C@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2cccc(F)c2s1
Show InChI InChI=1S/C26H29FN2O2S/c1-16-11-21-23(28-16)7-4-8-24(21)31-15-20(30)14-29-10-9-18(12-17(29)2)25-13-19-5-3-6-22(27)26(19)32-25/h3-8,11,13,17-18,20,28,30H,9-10,12,14-15H2,1-2H3/t17-,18-,20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
48n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135262
PNG
((S)-1-[(2S,4S)-4-(4-Methoxy-benzo[b]thiophen-2-yl)...)
Show SMILES COc1cccc2sc(cc12)[C@H]1CCN(C[C@H](O)COc2cccc3oc(C)cc23)[C@@H](C)C1
Show InChI InChI=1S/C27H31NO4S/c1-17-12-19(27-14-22-23(30-3)6-5-9-26(22)33-27)10-11-28(17)15-20(29)16-31-24-7-4-8-25-21(24)13-18(2)32-25/h4-9,13-14,17,19-20,29H,10-12,15-16H2,1-3H3/t17-,19-,20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
76n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (human))
BDBM50135251
PNG
((S)-1-[(2S,4R)-4-(4,6-Dimethyl-benzo[b]thiophen-2-...)
Show SMILES C[C@H]1C[C@@H](CCN1C[C@H](O)COc1cccc2[nH]c(C)cc12)c1cc2c(C)cc(C)cc2s1
Show InChI InChI=1S/C28H34N2O2S/c1-17-10-18(2)23-14-27(33-28(23)11-17)21-8-9-30(20(4)13-21)15-22(31)16-32-26-7-5-6-25-24(26)12-19(3)29-25/h5-7,10-12,14,20-22,29,31H,8-9,13,15-16H2,1-4H3/t20-,21+,22-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
105n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards 5-hydroxytryptamine 1A receptor in human using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50135245
PNG
((S)-1-[(2R,4R)-4-(4-Methoxy-benzo[b]thiophen-2-yl)...)
Show SMILES COc1cccc2sc(cc12)[C@@H]1CCN(C[C@H](O)COc2cccc3oc(C)cc23)[C@H](C)C1
Show InChI InChI=1S/C27H31NO4S/c1-17-12-19(27-14-22-23(30-3)6-5-9-26(22)33-27)10-11-28(17)15-20(29)16-31-24-7-4-8-25-21(24)13-18(2)32-25/h4-9,13-14,17,19-20,29H,10-12,15-16H2,1-3H3/t17-,19-,20+/m1/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
110n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
Monoamine transporters; serotonin & dopamine


(Rattus norvegicus (rat))
BDBM50135240
PNG
((S)-1-[4-(4-Methoxy-benzo[b]thiophen-2-yl)-2,2-dim...)
Show SMILES COc1cccc2sc(cc12)C1CCN(C[C@H](O)COc2cccc3[nH]c(C)cc23)C(C)(C)C1
Show InChI InChI=1S/C28H34N2O3S/c1-18-13-21-23(29-18)7-5-9-25(21)33-17-20(31)16-30-12-11-19(15-28(30,2)3)27-14-22-24(32-4)8-6-10-26(22)34-27/h5-10,13-14,19-20,29,31H,11-12,15-17H2,1-4H3/t19?,20-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
118n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Affinity at the 5-HT reuptake site labeled with [3H]-paroxetine using rat frontal cortex membranes


Bioorg Med Chem Lett 13: 3939-42 (2003)


Article DOI: 10.1016/j.bmcl.2003.09.002
BindingDB Entry DOI: 10.7270/Q24T6HSX
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%