Found 20 hits Enz. Inhib. hit(s) with all data for assayid = 1 entry = 50045346 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 |
|---|
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50098551
((R)-3-(2-(2-(4-methylpiperidin-1-yl)ethyl)pyrrolid...)Show SMILES CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cccc(O)c2)CC1 |r| Show InChI InChI=1S/C18H28N2O3S/c1-15-7-11-19(12-8-15)13-9-16-4-3-10-20(16)24(22,23)18-6-2-5-17(21)14-18/h2,5-6,14-16,21H,3-4,7-13H2,1H3/t16-/m1/s1 | PDB
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PubMed
| 0.340 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50058214
(CHEMBL3326982)Show SMILES COc1ccccc1N1CCN(CCCCC(=O)NCc2ccccc2-c2ccccc2Cl)CC1 Show InChI InChI=1S/C29H34ClN3O2/c1-35-28-15-7-6-14-27(28)33-20-18-32(19-21-33)17-9-8-16-29(34)31-22-23-10-2-3-11-24(23)25-12-4-5-13-26(25)30/h2-7,10-15H,8-9,16-22H2,1H3,(H,31,34) | PDB
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| 8.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50058069
(CHEMBL3326993)Show SMILES COc1ccccc1N1CCN(CCCCCC(=O)NCc2ccccc2-c2ccccc2Cl)CC1 Show InChI InChI=1S/C30H36ClN3O2/c1-36-29-16-9-8-15-28(29)34-21-19-33(20-22-34)18-10-2-3-17-30(35)32-23-24-11-4-5-12-25(24)26-13-6-7-14-27(26)31/h4-9,11-16H,2-3,10,17-23H2,1H3,(H,32,35) | PDB
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| 16 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50058162
(CHEMBL3326986)Show SMILES COc1cccc(c1)-c1ccccc1CNC(=O)CCCCN1CCN(CC1)c1ccccc1OC Show InChI InChI=1S/C30H37N3O3/c1-35-26-12-9-11-24(22-26)27-13-4-3-10-25(27)23-31-30(34)16-7-8-17-32-18-20-33(21-19-32)28-14-5-6-15-29(28)36-2/h3-6,9-15,22H,7-8,16-21,23H2,1-2H3,(H,31,34) | PDB
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| 22 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50058211
(CHEMBL3326984)Show SMILES COc1ccccc1N1CCN(CCCCC(=O)NCc2ccccc2-c2ccc(Cl)cc2)CC1 Show InChI InChI=1S/C29H34ClN3O2/c1-35-28-11-5-4-10-27(28)33-20-18-32(19-21-33)17-7-6-12-29(34)31-22-24-8-2-3-9-26(24)23-13-15-25(30)16-14-23/h2-5,8-11,13-16H,6-7,12,17-22H2,1H3,(H,31,34) | PDB
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| 26 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50058156
(CHEMBL3326989)Show SMILES COc1ccccc1N1CCN(CCCCC(=O)NCc2ccccc2-c2ccccc2C)CC1 Show InChI InChI=1S/C30H37N3O2/c1-24-11-3-5-13-26(24)27-14-6-4-12-25(27)23-31-30(34)17-9-10-18-32-19-21-33(22-20-32)28-15-7-8-16-29(28)35-2/h3-8,11-16H,9-10,17-23H2,1-2H3,(H,31,34) | PDB
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| 26 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50058209
(CHEMBL3326985)Show SMILES COc1ccccc1N1CCN(CCCCC(=O)NCc2ccccc2-c2ccccc2OC)CC1 Show InChI InChI=1S/C30H37N3O3/c1-35-28-15-7-5-13-26(28)25-12-4-3-11-24(25)23-31-30(34)17-9-10-18-32-19-21-33(22-20-32)27-14-6-8-16-29(27)36-2/h3-8,11-16H,9-10,17-23H2,1-2H3,(H,31,34) | PDB
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| 31 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50058157
(CHEMBL3326988)Show SMILES COc1ccccc1N1CCN(CCCCC(=O)NCc2ccccc2-c2c(OC)cccc2OC)CC1 |(26.8,-10.21,;25.47,-10.98,;25.48,-12.52,;26.82,-13.29,;26.82,-14.83,;25.49,-15.6,;24.15,-14.83,;24.16,-13.3,;22.83,-12.53,;21.49,-13.3,;20.16,-12.53,;20.16,-10.98,;18.82,-10.22,;17.49,-11,;16.16,-10.23,;14.83,-11.01,;13.49,-10.25,;13.48,-8.71,;12.16,-11.02,;10.82,-10.25,;9.49,-11.03,;9.5,-12.58,;8.16,-13.35,;6.82,-12.58,;6.83,-11.04,;8.16,-10.27,;8.15,-8.73,;6.81,-7.97,;5.47,-8.76,;5.49,-10.31,;6.8,-6.43,;8.14,-5.65,;9.48,-6.42,;9.48,-7.96,;10.81,-8.73,;12.16,-7.95,;21.49,-10.21,;22.82,-10.99,)| Show InChI InChI=1S/C31H39N3O4/c1-36-27-14-7-6-13-26(27)34-21-19-33(20-22-34)18-9-8-17-30(35)32-23-24-11-4-5-12-25(24)31-28(37-2)15-10-16-29(31)38-3/h4-7,10-16H,8-9,17-23H2,1-3H3,(H,32,35) | PDB
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| 32 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50058215
(CHEMBL3326981)Show SMILES COc1ccccc1N1CCN(CCCCC(=O)NCc2ccccc2-c2ccc(F)cc2)CC1 Show InChI InChI=1S/C29H34FN3O2/c1-35-28-11-5-4-10-27(28)33-20-18-32(19-21-33)17-7-6-12-29(34)31-22-24-8-2-3-9-26(24)23-13-15-25(30)16-14-23/h2-5,8-11,13-16H,6-7,12,17-22H2,1H3,(H,31,34) | PDB
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| 35 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50058216
(CHEMBL3326980)Show SMILES COc1ccccc1N1CCN(CCCCC(=O)NCc2ccccc2-c2cccc(F)c2)CC1 Show InChI InChI=1S/C29H34FN3O2/c1-35-28-14-5-4-13-27(28)33-19-17-32(18-20-33)16-7-6-15-29(34)31-22-24-9-2-3-12-26(24)23-10-8-11-25(30)21-23/h2-5,8-14,21H,6-7,15-20,22H2,1H3,(H,31,34) | PDB
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| 35 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50058217
(CHEMBL3326979)Show SMILES COc1ccccc1N1CCN(CCCCC(=O)NCc2ccccc2-c2ccccc2F)CC1 Show InChI InChI=1S/C29H34FN3O2/c1-35-28-15-7-6-14-27(28)33-20-18-32(19-21-33)17-9-8-16-29(34)31-22-23-10-2-3-11-24(23)25-12-4-5-13-26(25)30/h2-7,10-15H,8-9,16-22H2,1H3,(H,31,34) | PDB
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| 37 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50058219
(CHEMBL3325464)Show SMILES COc1ccccc1N1CCN(CCCCC(=O)NCc2ccccc2-c2ccccc2)CC1 Show InChI InChI=1S/C29H35N3O2/c1-34-28-16-8-7-15-27(28)32-21-19-31(20-22-32)18-10-9-17-29(33)30-23-25-13-5-6-14-26(25)24-11-3-2-4-12-24/h2-8,11-16H,9-10,17-23H2,1H3,(H,30,33) | PDB
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| 38 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50058218
(CHEMBL3326978)Show SMILES COc1ccccc1N1CCN(CCCCCC(=O)NCc2ccccc2-c2ccccc2)CC1 Show InChI InChI=1S/C30H37N3O2/c1-35-29-17-10-9-16-28(29)33-22-20-32(21-23-33)19-11-3-6-18-30(34)31-24-26-14-7-8-15-27(26)25-12-4-2-5-13-25/h2,4-5,7-10,12-17H,3,6,11,18-24H2,1H3,(H,31,34) | PDB
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| 44 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50058159
(CHEMBL3326987)Show SMILES COc1ccc(cc1)-c1ccccc1CNC(=O)CCCCN1CCN(CC1)c1ccccc1OC Show InChI InChI=1S/C30H37N3O3/c1-35-26-16-14-24(15-17-26)27-10-4-3-9-25(27)23-31-30(34)13-7-8-18-32-19-21-33(22-20-32)28-11-5-6-12-29(28)36-2/h3-6,9-12,14-17H,7-8,13,18-23H2,1-2H3,(H,31,34) | PDB
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| 44 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50058070
(CHEMBL3326992)Show SMILES COc1ccccc1N1CCN(CCCC(=O)NCc2ccccc2-c2ccccc2Cl)CC1 Show InChI InChI=1S/C28H32ClN3O2/c1-34-27-14-7-6-13-26(27)32-19-17-31(18-20-32)16-8-15-28(33)30-21-22-9-2-3-10-23(22)24-11-4-5-12-25(24)29/h2-7,9-14H,8,15-21H2,1H3,(H,30,33) | PDB
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| 47 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50058151
(CHEMBL3326990)Show SMILES COc1ccccc1N1CCN(CCCCC(=O)NCc2ccccc2-c2cccc(C)c2)CC1 Show InChI InChI=1S/C30H37N3O2/c1-24-10-9-12-25(22-24)27-13-4-3-11-26(27)23-31-30(34)16-7-8-17-32-18-20-33(21-19-32)28-14-5-6-15-29(28)35-2/h3-6,9-15,22H,7-8,16-21,23H2,1-2H3,(H,31,34) | PDB
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| 48 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50058282
(CHEMBL3326977)Show SMILES COc1ccccc1N1CCN(CCCC(=O)NCc2ccccc2-c2ccccc2)CC1 Show InChI InChI=1S/C28H33N3O2/c1-33-27-15-8-7-14-26(27)31-20-18-30(19-21-31)17-9-16-28(32)29-22-24-12-5-6-13-25(24)23-10-3-2-4-11-23/h2-8,10-15H,9,16-22H2,1H3,(H,29,32) | PDB
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| 65 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50058071
(CHEMBL3326991)Show SMILES COc1ccccc1N1CCN(CCCCC(=O)NCc2ccccc2-c2ccc(C)cc2)CC1 Show InChI InChI=1S/C30H37N3O2/c1-24-14-16-25(17-15-24)27-10-4-3-9-26(27)23-31-30(34)13-7-8-18-32-19-21-33(22-20-32)28-11-5-6-12-29(28)35-2/h3-6,9-12,14-17H,7-8,13,18-23H2,1-2H3,(H,31,34) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 66 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50058284
(CHEMBL3326976)Show SMILES COc1ccccc1N1CCN(CCC(=O)NCc2ccccc2-c2ccccc2)CC1 Show InChI InChI=1S/C27H31N3O2/c1-32-26-14-8-7-13-25(26)30-19-17-29(18-20-30)16-15-27(31)28-21-23-11-5-6-12-24(23)22-9-3-2-4-10-22/h2-14H,15-21H2,1H3,(H,28,31) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 187 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 7
(Homo sapiens (Human)) | BDBM50058213
(CHEMBL3326983)Show SMILES COc1ccccc1N1CCN(CCCCC(=O)NCc2ccccc2-c2cccc(Cl)c2)CC1 Show InChI InChI=1S/C29H34ClN3O2/c1-35-28-14-5-4-13-27(28)33-19-17-32(18-20-33)16-7-6-15-29(34)31-22-24-9-2-3-12-26(24)23-10-8-11-25(30)21-23/h2-5,8-14,21H,6-7,15-20,22H2,1H3,(H,31,34) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 405 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description
Displacement of [3H]LSD from 5-HT7R (unknown origin) expressed in CHO-K1 cells by liquid scintillation counting method |
Bioorg Med Chem 22: 4587-96 (2014)
Article DOI: 10.1016/j.bmc.2014.07.026
BindingDB Entry DOI: 10.7270/Q22N53ZG |
More data for this
Ligand-Target Pair | |
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