Found 51 hits of Enzyme Inhibition Constant Data 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)) | BDBM50145347
(1-(2-(4-(6-fluoro-1H-indol-3-yl)-5,6-dihydropyridi...)Show SMILES NC(=O)c1ccc2C(CCN3CCC(=CC3)c3c[nH]c4cc(F)ccc34)OCCc2c1 |c:13| Show InChI InChI=1S/C25H26FN3O2/c26-19-2-4-21-22(15-28-23(21)14-19)16-5-9-29(10-6-16)11-7-24-20-3-1-18(25(27)30)13-17(20)8-12-31-24/h1-5,13-15,24,28H,6-12H2,(H2,27,30) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from human 5HT transpoter expressed in HEK293 cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50210638
(1-(2-((R)-4-(6-fluoronaphthalen-1-yl)-2-methylpipe...)Show SMILES C[C@@H]1CN(CCN1CCC1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(F)ccc12 |w:9.9| Show InChI InChI=1S/C27H30FN3O2/c1-18-17-31(25-4-2-3-19-16-22(28)6-8-23(19)25)13-12-30(18)11-9-26-24-7-5-21(27(29)32)15-20(24)10-14-33-26/h2-8,15-16,18,26H,9-14,17H2,1H3,(H2,29,32)/t18-,26?/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.800 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from human 5HT transpoter expressed in HEK293 cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1D
(Homo sapiens (Human)) | BDBM50210642
((S)-1-(2-((S)-4-(6-cyanonaphthalen-1-yl)-2-methylp...)Show SMILES C[C@H]1CN(CCN1CC[C@@H]1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(ccc12)C#N Show InChI InChI=1S/C28H30N4O2/c1-19-18-32(26-4-2-3-21-15-20(17-29)5-7-24(21)26)13-12-31(19)11-9-27-25-8-6-23(28(30)33)16-22(25)10-14-34-27/h2-8,15-16,19,27H,9-14,18H2,1H3,(H2,30,33)/t19-,27-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.900 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1D expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1D
(Homo sapiens (Human)) | BDBM50210635
((S)-1-(2-(4-(6-cyanonaphthalen-1-yl)piperazin-1-yl...)Show SMILES NC(=O)c1ccc2[C@H](CCN3CCN(CC3)c3cccc4cc(ccc34)C#N)OCCc2c1 Show InChI InChI=1S/C27H28N4O2/c28-18-19-4-6-23-20(16-19)2-1-3-25(23)31-13-11-30(12-14-31)10-8-26-24-7-5-22(27(29)32)17-21(24)9-15-33-26/h1-7,16-17,26H,8-15H2,(H2,29,32)/t26-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
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 |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1D expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50210640
((1R)-1-(2-((S)-4-(6-cyanonaphthalen-1-yl)-2-methyl...)Show SMILES C[C@H]1CN(CCN1CC[C@H]1OCC2=CC(=CCC12)C(N)=O)c1cccc2cc(ccc12)C#N |w:17.17,c:15,t:13| Show InChI InChI=1S/C27H30N4O2/c1-18-16-31(25-4-2-3-20-13-19(15-28)5-7-23(20)25)12-11-30(18)10-9-26-24-8-6-21(27(29)32)14-22(24)17-33-26/h2-7,13-14,18,24,26H,8-12,16-17H2,1H3,(H2,29,32)/t18-,24?,26+/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
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 |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from human 5HT transpoter expressed in HEK293 cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50210637
((1S)-1-(2-((S)-4-(6-fluoronaphthalen-1-yl)-2-methy...)Show SMILES C[C@H]1CN(CCN1CC[C@@H]1OCC2=CC(=CCC12)C(N)=O)c1cccc2cc(F)ccc12 |w:17.17,c:15,t:13| Show InChI InChI=1S/C26H30FN3O2/c1-17-15-30(24-4-2-3-18-14-21(27)6-8-22(18)24)12-11-29(17)10-9-25-23-7-5-19(26(28)31)13-20(23)16-32-25/h2-6,8,13-14,17,23,25H,7,9-12,15-16H2,1H3,(H2,28,31)/t17-,23?,25-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
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 |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from human 5HT transpoter expressed in HEK293 cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1D
(Homo sapiens (Human)) | BDBM50210640
((1R)-1-(2-((S)-4-(6-cyanonaphthalen-1-yl)-2-methyl...)Show SMILES C[C@H]1CN(CCN1CC[C@H]1OCC2=CC(=CCC12)C(N)=O)c1cccc2cc(ccc12)C#N |w:17.17,c:15,t:13| Show InChI InChI=1S/C27H30N4O2/c1-18-16-31(25-4-2-3-20-13-19(15-28)5-7-23(20)25)12-11-30(18)10-9-26-24-8-6-21(27(29)32)14-22(24)17-33-26/h2-7,13-14,18,24,26H,8-12,16-17H2,1H3,(H2,29,32)/t18-,24?,26+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1D expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50210641
((S)-1-(2-((S)-4-(6-fluoronaphthalen-2-yl)-2-methyl...)Show SMILES C[C@H]1CN(CCN1CC[C@@H]1OCCc2cc(ccc12)C(N)=O)c1ccc2cc(F)ccc2c1 Show InChI InChI=1S/C27H30FN3O2/c1-18-17-31(24-6-3-19-15-23(28)5-2-20(19)16-24)12-11-30(18)10-8-26-25-7-4-22(27(29)32)14-21(25)9-13-33-26/h2-7,14-16,18,26H,8-13,17H2,1H3,(H2,29,32)/t18-,26-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
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 |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from human 5HT transpoter expressed in HEK293 cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50210642
((S)-1-(2-((S)-4-(6-cyanonaphthalen-1-yl)-2-methylp...)Show SMILES C[C@H]1CN(CCN1CC[C@@H]1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(ccc12)C#N Show InChI InChI=1S/C28H30N4O2/c1-19-18-32(26-4-2-3-21-15-20(17-29)5-7-24(21)26)13-12-31(19)11-9-27-25-8-6-23(28(30)33)16-22(25)10-14-34-27/h2-8,15-16,19,27H,9-14,18H2,1H3,(H2,30,33)/t19-,27-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from human 5HT transpoter expressed in HEK293 cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50210633
((S)-1-(2-((R)-4-(6-fluoronaphthalen-1-yl)-2-methyl...)Show SMILES C[C@@H]1CN(CCN1CC[C@@H]1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(F)ccc12 Show InChI InChI=1S/C27H30FN3O2/c1-18-17-31(25-4-2-3-19-16-22(28)6-8-23(19)25)13-12-30(18)11-9-26-24-7-5-21(27(29)32)15-20(24)10-14-33-26/h2-8,15-16,18,26H,9-14,17H2,1H3,(H2,29,32)/t18-,26+/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
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 |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from human 5HT transpoter expressed in HEK293 cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Rattus norvegicus (rat)) | BDBM50210638
(1-(2-((R)-4-(6-fluoronaphthalen-1-yl)-2-methylpipe...)Show SMILES C[C@@H]1CN(CCN1CCC1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(F)ccc12 |w:9.9| Show InChI InChI=1S/C27H30FN3O2/c1-18-17-31(25-4-2-3-19-16-22(28)6-8-23(19)25)13-12-30(18)11-9-26-24-7-5-21(27(29)32)15-20(24)10-14-33-26/h2-8,15-16,18,26H,9-14,17H2,1H3,(H2,29,32)/t18-,26?/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]raclopride from dopamine D2 receptor in rat caudate membranes |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50210635
((S)-1-(2-(4-(6-cyanonaphthalen-1-yl)piperazin-1-yl...)Show SMILES NC(=O)c1ccc2[C@H](CCN3CCN(CC3)c3cccc4cc(ccc34)C#N)OCCc2c1 Show InChI InChI=1S/C27H28N4O2/c28-18-19-4-6-23-20(16-19)2-1-3-25(23)31-13-11-30(12-14-31)10-8-26-24-7-5-22(27(29)32)17-21(24)9-15-33-26/h1-7,16-17,26H,8-15H2,(H2,29,32)/t26-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from human 5HT transpoter expressed in HEK293 cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1D
(Homo sapiens (Human)) | BDBM50210633
((S)-1-(2-((R)-4-(6-fluoronaphthalen-1-yl)-2-methyl...)Show SMILES C[C@@H]1CN(CCN1CC[C@@H]1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(F)ccc12 Show InChI InChI=1S/C27H30FN3O2/c1-18-17-31(25-4-2-3-19-16-22(28)6-8-23(19)25)13-12-30(18)11-9-26-24-7-5-21(27(29)32)15-20(24)10-14-33-26/h2-8,15-16,18,26H,9-14,17H2,1H3,(H2,29,32)/t18-,26+/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1D expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50210639
((R)-1-(2-((R)-4-(6-fluoronaphthalen-1-yl)-2-methyl...)Show SMILES C[C@@H]1CN(CCN1CC[C@H]1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(F)ccc12 Show InChI InChI=1S/C27H30FN3O2/c1-18-17-31(25-4-2-3-19-16-22(28)6-8-23(19)25)13-12-30(18)11-9-26-24-7-5-21(27(29)32)15-20(24)10-14-33-26/h2-8,15-16,18,26H,9-14,17H2,1H3,(H2,29,32)/t18-,26-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 7.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from human 5HT transpoter expressed in HEK293 cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1D
(Homo sapiens (Human)) | BDBM50145347
(1-(2-(4-(6-fluoro-1H-indol-3-yl)-5,6-dihydropyridi...)Show SMILES NC(=O)c1ccc2C(CCN3CCC(=CC3)c3c[nH]c4cc(F)ccc34)OCCc2c1 |c:13| Show InChI InChI=1S/C25H26FN3O2/c26-19-2-4-21-22(15-28-23(21)14-19)16-5-9-29(10-6-16)11-7-24-20-3-1-18(25(27)30)13-17(20)8-12-31-24/h1-5,13-15,24,28H,6-12H2,(H2,27,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1D expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50210636
((S)-1-(2-(4-(6-fluoronaphthalen-2-yl)piperazin-1-y...)Show SMILES NC(=O)c1ccc2[C@H](CCN3CCN(CC3)c3ccc4cc(F)ccc4c3)OCCc2c1 Show InChI InChI=1S/C26H28FN3O2/c27-22-4-1-19-17-23(5-2-18(19)16-22)30-12-10-29(11-13-30)9-7-25-24-6-3-21(26(28)31)15-20(24)8-14-32-25/h1-6,15-17,25H,7-14H2,(H2,28,31)/t25-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 8.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from human 5HT transpoter expressed in HEK293 cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
Sodium-dependent serotonin transporter
(Homo sapiens (Human)) | BDBM50210634
((1R)-1-(2-((S)-4-(6-fluoronaphthalen-1-yl)-2-methy...)Show SMILES C[C@H]1CN(CCN1CC[C@H]1OCC2=CC(=CCC12)C(N)=O)c1cccc2cc(F)ccc12 |w:17.17,c:15,t:13| Show InChI InChI=1S/C26H30FN3O2/c1-17-15-30(24-4-2-3-18-14-21(27)6-8-22(18)24)12-11-29(17)10-9-25-23-7-5-19(26(28)31)13-20(23)16-32-25/h2-6,8,13-14,17,23,25H,7,9-12,15-16H2,1H3,(H2,28,31)/t17-,23?,25+/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 8.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]citalopram from human 5HT transpoter expressed in HEK293 cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1D
(Homo sapiens (Human)) | BDBM50210636
((S)-1-(2-(4-(6-fluoronaphthalen-2-yl)piperazin-1-y...)Show SMILES NC(=O)c1ccc2[C@H](CCN3CCN(CC3)c3ccc4cc(F)ccc4c3)OCCc2c1 Show InChI InChI=1S/C26H28FN3O2/c27-22-4-1-19-17-23(5-2-18(19)16-22)30-12-10-29(11-13-30)9-7-25-24-6-3-21(26(28)31)15-20(24)8-14-32-25/h1-6,15-17,25H,7-14H2,(H2,28,31)/t25-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1D expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1A
(Homo sapiens (Human)) | BDBM50210637
((1S)-1-(2-((S)-4-(6-fluoronaphthalen-1-yl)-2-methy...)Show SMILES C[C@H]1CN(CCN1CC[C@@H]1OCC2=CC(=CCC12)C(N)=O)c1cccc2cc(F)ccc12 |w:17.17,c:15,t:13| Show InChI InChI=1S/C26H30FN3O2/c1-17-15-30(24-4-2-3-18-14-21(27)6-8-22(18)24)12-11-29(17)10-9-25-23-7-5-19(26(28)31)13-20(23)16-32-25/h2-6,8,13-14,17,23,25H,7,9-12,15-16H2,1H3,(H2,28,31)/t17-,23?,25-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 13 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]8-OH-DPAT from human 5HT1A expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1A
(Homo sapiens (Human)) | BDBM50210634
((1R)-1-(2-((S)-4-(6-fluoronaphthalen-1-yl)-2-methy...)Show SMILES C[C@H]1CN(CCN1CC[C@H]1OCC2=CC(=CCC12)C(N)=O)c1cccc2cc(F)ccc12 |w:17.17,c:15,t:13| Show InChI InChI=1S/C26H30FN3O2/c1-17-15-30(24-4-2-3-18-14-21(27)6-8-22(18)24)12-11-29(17)10-9-25-23-7-5-19(26(28)31)13-20(23)16-32-25/h2-6,8,13-14,17,23,25H,7,9-12,15-16H2,1H3,(H2,28,31)/t17-,23?,25+/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 13 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]8-OH-DPAT from human 5HT1A expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1D
(Homo sapiens (Human)) | BDBM50210641
((S)-1-(2-((S)-4-(6-fluoronaphthalen-2-yl)-2-methyl...)Show SMILES C[C@H]1CN(CCN1CC[C@@H]1OCCc2cc(ccc12)C(N)=O)c1ccc2cc(F)ccc2c1 Show InChI InChI=1S/C27H30FN3O2/c1-18-17-31(24-6-3-19-15-23(28)5-2-20(19)16-24)12-11-30(18)10-8-26-25-7-4-22(27(29)32)14-21(25)9-13-33-26/h2-7,14-16,18,26H,8-13,17H2,1H3,(H2,29,32)/t18-,26-/m0/s1 | PDB
Reactome pathway
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 |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1D expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1D
(Homo sapiens (Human)) | BDBM50210637
((1S)-1-(2-((S)-4-(6-fluoronaphthalen-1-yl)-2-methy...)Show SMILES C[C@H]1CN(CCN1CC[C@@H]1OCC2=CC(=CCC12)C(N)=O)c1cccc2cc(F)ccc12 |w:17.17,c:15,t:13| Show InChI InChI=1S/C26H30FN3O2/c1-17-15-30(24-4-2-3-18-14-21(27)6-8-22(18)24)12-11-29(17)10-9-25-23-7-5-19(26(28)31)13-20(23)16-32-25/h2-6,8,13-14,17,23,25H,7,9-12,15-16H2,1H3,(H2,28,31)/t17-,23?,25-/m0/s1 | PDB
Reactome pathway
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 |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1D expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1B
(Homo sapiens (Human)) | BDBM50210635
((S)-1-(2-(4-(6-cyanonaphthalen-1-yl)piperazin-1-yl...)Show SMILES NC(=O)c1ccc2[C@H](CCN3CCN(CC3)c3cccc4cc(ccc34)C#N)OCCc2c1 Show InChI InChI=1S/C27H28N4O2/c28-18-19-4-6-23-20(16-19)2-1-3-25(23)31-13-11-30(12-14-31)10-8-26-24-7-5-22(27(29)32)17-21(24)9-15-33-26/h1-7,16-17,26H,8-15H2,(H2,29,32)/t26-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 15 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1B expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1A
(Homo sapiens (Human)) | BDBM50210635
((S)-1-(2-(4-(6-cyanonaphthalen-1-yl)piperazin-1-yl...)Show SMILES NC(=O)c1ccc2[C@H](CCN3CCN(CC3)c3cccc4cc(ccc34)C#N)OCCc2c1 Show InChI InChI=1S/C27H28N4O2/c28-18-19-4-6-23-20(16-19)2-1-3-25(23)31-13-11-30(12-14-31)10-8-26-24-7-5-22(27(29)32)17-21(24)9-15-33-26/h1-7,16-17,26H,8-15H2,(H2,29,32)/t26-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 16 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]8-OH-DPAT from human 5HT1A expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1B
(Homo sapiens (Human)) | BDBM50210642
((S)-1-(2-((S)-4-(6-cyanonaphthalen-1-yl)-2-methylp...)Show SMILES C[C@H]1CN(CCN1CC[C@@H]1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(ccc12)C#N Show InChI InChI=1S/C28H30N4O2/c1-19-18-32(26-4-2-3-21-15-20(17-29)5-7-24(21)26)13-12-31(19)11-9-27-25-8-6-23(28(30)33)16-22(25)10-14-34-27/h2-8,15-16,19,27H,9-14,18H2,1H3,(H2,30,33)/t19-,27-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 21 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1B expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1A
(Homo sapiens (Human)) | BDBM50210642
((S)-1-(2-((S)-4-(6-cyanonaphthalen-1-yl)-2-methylp...)Show SMILES C[C@H]1CN(CCN1CC[C@@H]1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(ccc12)C#N Show InChI InChI=1S/C28H30N4O2/c1-19-18-32(26-4-2-3-21-15-20(17-29)5-7-24(21)26)13-12-31(19)11-9-27-25-8-6-23(28(30)33)16-22(25)10-14-34-27/h2-8,15-16,19,27H,9-14,18H2,1H3,(H2,30,33)/t19-,27-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 26 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]8-OH-DPAT from human 5HT1A expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Rattus norvegicus (rat)) | BDBM50210637
((1S)-1-(2-((S)-4-(6-fluoronaphthalen-1-yl)-2-methy...)Show SMILES C[C@H]1CN(CCN1CC[C@@H]1OCC2=CC(=CCC12)C(N)=O)c1cccc2cc(F)ccc12 |w:17.17,c:15,t:13| Show InChI InChI=1S/C26H30FN3O2/c1-17-15-30(24-4-2-3-18-14-21(27)6-8-22(18)24)12-11-29(17)10-9-25-23-7-5-19(26(28)31)13-20(23)16-32-25/h2-6,8,13-14,17,23,25H,7,9-12,15-16H2,1H3,(H2,28,31)/t17-,23?,25-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 26 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]raclopride from dopamine D2 receptor in rat caudate membranes |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Rattus norvegicus (rat)) | BDBM50145347
(1-(2-(4-(6-fluoro-1H-indol-3-yl)-5,6-dihydropyridi...)Show SMILES NC(=O)c1ccc2C(CCN3CCC(=CC3)c3c[nH]c4cc(F)ccc34)OCCc2c1 |c:13| Show InChI InChI=1S/C25H26FN3O2/c26-19-2-4-21-22(15-28-23(21)14-19)16-5-9-29(10-6-16)11-7-24-20-3-1-18(25(27)30)13-17(20)8-12-31-24/h1-5,13-15,24,28H,6-12H2,(H2,27,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 42 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]raclopride from dopamine D2 receptor in rat caudate membranes |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1D
(Homo sapiens (Human)) | BDBM50210638
(1-(2-((R)-4-(6-fluoronaphthalen-1-yl)-2-methylpipe...)Show SMILES C[C@@H]1CN(CCN1CCC1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(F)ccc12 |w:9.9| Show InChI InChI=1S/C27H30FN3O2/c1-18-17-31(25-4-2-3-19-16-22(28)6-8-23(19)25)13-12-30(18)11-9-26-24-7-5-21(27(29)32)15-20(24)10-14-33-26/h2-8,15-16,18,26H,9-14,17H2,1H3,(H2,29,32)/t18-,26?/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 56 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1D expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1D
(Homo sapiens (Human)) | BDBM50210634
((1R)-1-(2-((S)-4-(6-fluoronaphthalen-1-yl)-2-methy...)Show SMILES C[C@H]1CN(CCN1CC[C@H]1OCC2=CC(=CCC12)C(N)=O)c1cccc2cc(F)ccc12 |w:17.17,c:15,t:13| Show InChI InChI=1S/C26H30FN3O2/c1-17-15-30(24-4-2-3-18-14-21(27)6-8-22(18)24)12-11-29(17)10-9-25-23-7-5-19(26(28)31)13-20(23)16-32-25/h2-6,8,13-14,17,23,25H,7,9-12,15-16H2,1H3,(H2,28,31)/t17-,23?,25+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 67 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1D expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Rattus norvegicus (rat)) | BDBM50210633
((S)-1-(2-((R)-4-(6-fluoronaphthalen-1-yl)-2-methyl...)Show SMILES C[C@@H]1CN(CCN1CC[C@@H]1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(F)ccc12 Show InChI InChI=1S/C27H30FN3O2/c1-18-17-31(25-4-2-3-19-16-22(28)6-8-23(19)25)13-12-30(18)11-9-26-24-7-5-21(27(29)32)15-20(24)10-14-33-26/h2-8,15-16,18,26H,9-14,17H2,1H3,(H2,29,32)/t18-,26+/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 71 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]raclopride from dopamine D2 receptor in rat caudate membranes |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Rattus norvegicus (rat)) | BDBM50210639
((R)-1-(2-((R)-4-(6-fluoronaphthalen-1-yl)-2-methyl...)Show SMILES C[C@@H]1CN(CCN1CC[C@H]1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(F)ccc12 Show InChI InChI=1S/C27H30FN3O2/c1-18-17-31(25-4-2-3-19-16-22(28)6-8-23(19)25)13-12-30(18)11-9-26-24-7-5-21(27(29)32)15-20(24)10-14-33-26/h2-8,15-16,18,26H,9-14,17H2,1H3,(H2,29,32)/t18-,26-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 78 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]raclopride from dopamine D2 receptor in rat caudate membranes |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1B
(Homo sapiens (Human)) | BDBM50210640
((1R)-1-(2-((S)-4-(6-cyanonaphthalen-1-yl)-2-methyl...)Show SMILES C[C@H]1CN(CCN1CC[C@H]1OCC2=CC(=CCC12)C(N)=O)c1cccc2cc(ccc12)C#N |w:17.17,c:15,t:13| Show InChI InChI=1S/C27H30N4O2/c1-18-16-31(25-4-2-3-20-13-19(15-28)5-7-23(20)25)12-11-30(18)10-9-26-24-8-6-21(27(29)32)14-22(24)17-33-26/h2-7,13-14,18,24,26H,8-12,16-17H2,1H3,(H2,29,32)/t18-,24?,26+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 88 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1B expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1D
(Homo sapiens (Human)) | BDBM50210639
((R)-1-(2-((R)-4-(6-fluoronaphthalen-1-yl)-2-methyl...)Show SMILES C[C@@H]1CN(CCN1CC[C@H]1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(F)ccc12 Show InChI InChI=1S/C27H30FN3O2/c1-18-17-31(25-4-2-3-19-16-22(28)6-8-23(19)25)13-12-30(18)11-9-26-24-7-5-21(27(29)32)15-20(24)10-14-33-26/h2-8,15-16,18,26H,9-14,17H2,1H3,(H2,29,32)/t18-,26-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 88 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1D expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Rattus norvegicus (rat)) | BDBM50210635
((S)-1-(2-(4-(6-cyanonaphthalen-1-yl)piperazin-1-yl...)Show SMILES NC(=O)c1ccc2[C@H](CCN3CCN(CC3)c3cccc4cc(ccc34)C#N)OCCc2c1 Show InChI InChI=1S/C27H28N4O2/c28-18-19-4-6-23-20(16-19)2-1-3-25(23)31-13-11-30(12-14-31)10-8-26-24-7-5-22(27(29)32)17-21(24)9-15-33-26/h1-7,16-17,26H,8-15H2,(H2,29,32)/t26-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 88 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]raclopride from dopamine D2 receptor in rat caudate membranes |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1B
(Homo sapiens (Human)) | BDBM50210639
((R)-1-(2-((R)-4-(6-fluoronaphthalen-1-yl)-2-methyl...)Show SMILES C[C@@H]1CN(CCN1CC[C@H]1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(F)ccc12 Show InChI InChI=1S/C27H30FN3O2/c1-18-17-31(25-4-2-3-19-16-22(28)6-8-23(19)25)13-12-30(18)11-9-26-24-7-5-21(27(29)32)15-20(24)10-14-33-26/h2-8,15-16,18,26H,9-14,17H2,1H3,(H2,29,32)/t18-,26-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 91 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1B expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1B
(Homo sapiens (Human)) | BDBM50210633
((S)-1-(2-((R)-4-(6-fluoronaphthalen-1-yl)-2-methyl...)Show SMILES C[C@@H]1CN(CCN1CC[C@@H]1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(F)ccc12 Show InChI InChI=1S/C27H30FN3O2/c1-18-17-31(25-4-2-3-19-16-22(28)6-8-23(19)25)13-12-30(18)11-9-26-24-7-5-21(27(29)32)15-20(24)10-14-33-26/h2-8,15-16,18,26H,9-14,17H2,1H3,(H2,29,32)/t18-,26+/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 103 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1B expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1A
(Homo sapiens (Human)) | BDBM50210639
((R)-1-(2-((R)-4-(6-fluoronaphthalen-1-yl)-2-methyl...)Show SMILES C[C@@H]1CN(CCN1CC[C@H]1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(F)ccc12 Show InChI InChI=1S/C27H30FN3O2/c1-18-17-31(25-4-2-3-19-16-22(28)6-8-23(19)25)13-12-30(18)11-9-26-24-7-5-21(27(29)32)15-20(24)10-14-33-26/h2-8,15-16,18,26H,9-14,17H2,1H3,(H2,29,32)/t18-,26-/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 105 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]8-OH-DPAT from human 5HT1A expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Rattus norvegicus (rat)) | BDBM50210634
((1R)-1-(2-((S)-4-(6-fluoronaphthalen-1-yl)-2-methy...)Show SMILES C[C@H]1CN(CCN1CC[C@H]1OCC2=CC(=CCC12)C(N)=O)c1cccc2cc(F)ccc12 |w:17.17,c:15,t:13| Show InChI InChI=1S/C26H30FN3O2/c1-17-15-30(24-4-2-3-18-14-21(27)6-8-22(18)24)12-11-29(17)10-9-25-23-7-5-19(26(28)31)13-20(23)16-32-25/h2-6,8,13-14,17,23,25H,7,9-12,15-16H2,1H3,(H2,28,31)/t17-,23?,25+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 107 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]raclopride from dopamine D2 receptor in rat caudate membranes |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1B
(Homo sapiens (Human)) | BDBM50210637
((1S)-1-(2-((S)-4-(6-fluoronaphthalen-1-yl)-2-methy...)Show SMILES C[C@H]1CN(CCN1CC[C@@H]1OCC2=CC(=CCC12)C(N)=O)c1cccc2cc(F)ccc12 |w:17.17,c:15,t:13| Show InChI InChI=1S/C26H30FN3O2/c1-17-15-30(24-4-2-3-18-14-21(27)6-8-22(18)24)12-11-29(17)10-9-25-23-7-5-19(26(28)31)13-20(23)16-32-25/h2-6,8,13-14,17,23,25H,7,9-12,15-16H2,1H3,(H2,28,31)/t17-,23?,25-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 114 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1B expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1A
(Homo sapiens (Human)) | BDBM50210633
((S)-1-(2-((R)-4-(6-fluoronaphthalen-1-yl)-2-methyl...)Show SMILES C[C@@H]1CN(CCN1CC[C@@H]1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(F)ccc12 Show InChI InChI=1S/C27H30FN3O2/c1-18-17-31(25-4-2-3-19-16-22(28)6-8-23(19)25)13-12-30(18)11-9-26-24-7-5-21(27(29)32)15-20(24)10-14-33-26/h2-8,15-16,18,26H,9-14,17H2,1H3,(H2,29,32)/t18-,26+/m1/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 115 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]8-OH-DPAT from human 5HT1A expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1B
(Homo sapiens (Human)) | BDBM50145347
(1-(2-(4-(6-fluoro-1H-indol-3-yl)-5,6-dihydropyridi...)Show SMILES NC(=O)c1ccc2C(CCN3CCC(=CC3)c3c[nH]c4cc(F)ccc34)OCCc2c1 |c:13| Show InChI InChI=1S/C25H26FN3O2/c26-19-2-4-21-22(15-28-23(21)14-19)16-5-9-29(10-6-16)11-7-24-20-3-1-18(25(27)30)13-17(20)8-12-31-24/h1-5,13-15,24,28H,6-12H2,(H2,27,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 203 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1B expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1B
(Homo sapiens (Human)) | BDBM50210638
(1-(2-((R)-4-(6-fluoronaphthalen-1-yl)-2-methylpipe...)Show SMILES C[C@@H]1CN(CCN1CCC1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(F)ccc12 |w:9.9| Show InChI InChI=1S/C27H30FN3O2/c1-18-17-31(25-4-2-3-19-16-22(28)6-8-23(19)25)13-12-30(18)11-9-26-24-7-5-21(27(29)32)15-20(24)10-14-33-26/h2-8,15-16,18,26H,9-14,17H2,1H3,(H2,29,32)/t18-,26?/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 281 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1B expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Rattus norvegicus (rat)) | BDBM50210642
((S)-1-(2-((S)-4-(6-cyanonaphthalen-1-yl)-2-methylp...)Show SMILES C[C@H]1CN(CCN1CC[C@@H]1OCCc2cc(ccc12)C(N)=O)c1cccc2cc(ccc12)C#N Show InChI InChI=1S/C28H30N4O2/c1-19-18-32(26-4-2-3-21-15-20(17-29)5-7-24(21)26)13-12-31(19)11-9-27-25-8-6-23(28(30)33)16-22(25)10-14-34-27/h2-8,15-16,19,27H,9-14,18H2,1H3,(H2,30,33)/t19-,27-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 287 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]raclopride from dopamine D2 receptor in rat caudate membranes |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1A
(Homo sapiens (Human)) | BDBM50210641
((S)-1-(2-((S)-4-(6-fluoronaphthalen-2-yl)-2-methyl...)Show SMILES C[C@H]1CN(CCN1CC[C@@H]1OCCc2cc(ccc12)C(N)=O)c1ccc2cc(F)ccc2c1 Show InChI InChI=1S/C27H30FN3O2/c1-18-17-31(24-6-3-19-15-23(28)5-2-20(19)16-24)12-11-30(18)10-8-26-25-7-4-22(27(29)32)14-21(25)9-13-33-26/h2-7,14-16,18,26H,8-13,17H2,1H3,(H2,29,32)/t18-,26-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 307 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]8-OH-DPAT from human 5HT1A expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Rattus norvegicus (rat)) | BDBM50210640
((1R)-1-(2-((S)-4-(6-cyanonaphthalen-1-yl)-2-methyl...)Show SMILES C[C@H]1CN(CCN1CC[C@H]1OCC2=CC(=CCC12)C(N)=O)c1cccc2cc(ccc12)C#N |w:17.17,c:15,t:13| Show InChI InChI=1S/C27H30N4O2/c1-18-16-31(25-4-2-3-20-13-19(15-28)5-7-23(20)25)12-11-30(18)10-9-26-24-8-6-21(27(29)32)14-22(24)17-33-26/h2-7,13-14,18,24,26H,8-12,16-17H2,1H3,(H2,29,32)/t18-,24?,26+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 346 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]raclopride from dopamine D2 receptor in rat caudate membranes |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Rattus norvegicus (rat)) | BDBM50210636
((S)-1-(2-(4-(6-fluoronaphthalen-2-yl)piperazin-1-y...)Show SMILES NC(=O)c1ccc2[C@H](CCN3CCN(CC3)c3ccc4cc(F)ccc4c3)OCCc2c1 Show InChI InChI=1S/C26H28FN3O2/c27-22-4-1-19-17-23(5-2-18(19)16-22)30-12-10-29(11-13-30)9-7-25-24-6-3-21(26(28)31)15-20(24)8-14-32-25/h1-6,15-17,25H,7-14H2,(H2,28,31)/t25-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 704 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]raclopride from dopamine D2 receptor in rat caudate membranes |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1B
(Homo sapiens (Human)) | BDBM50210641
((S)-1-(2-((S)-4-(6-fluoronaphthalen-2-yl)-2-methyl...)Show SMILES C[C@H]1CN(CCN1CC[C@@H]1OCCc2cc(ccc12)C(N)=O)c1ccc2cc(F)ccc2c1 Show InChI InChI=1S/C27H30FN3O2/c1-18-17-31(24-6-3-19-15-23(28)5-2-20(19)16-24)12-11-30(18)10-8-26-25-7-4-22(27(29)32)14-21(25)9-13-33-26/h2-7,14-16,18,26H,8-13,17H2,1H3,(H2,29,32)/t18-,26-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1B expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1B
(Homo sapiens (Human)) | BDBM50210634
((1R)-1-(2-((S)-4-(6-fluoronaphthalen-1-yl)-2-methy...)Show SMILES C[C@H]1CN(CCN1CC[C@H]1OCC2=CC(=CCC12)C(N)=O)c1cccc2cc(F)ccc12 |w:17.17,c:15,t:13| Show InChI InChI=1S/C26H30FN3O2/c1-17-15-30(24-4-2-3-18-14-21(27)6-8-22(18)24)12-11-29(17)10-9-25-23-7-5-19(26(28)31)13-20(23)16-32-25/h2-6,8,13-14,17,23,25H,7,9-12,15-16H2,1H3,(H2,28,31)/t17-,23?,25+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1B expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
5-hydroxytryptamine receptor 1B
(Homo sapiens (Human)) | BDBM50210636
((S)-1-(2-(4-(6-fluoronaphthalen-2-yl)piperazin-1-y...)Show SMILES NC(=O)c1ccc2[C@H](CCN3CCN(CC3)c3ccc4cc(F)ccc4c3)OCCc2c1 Show InChI InChI=1S/C26H28FN3O2/c27-22-4-1-19-17-23(5-2-18(19)16-22)30-12-10-29(11-13-30)9-7-25-24-6-3-21(26(28)31)15-20(24)8-14-32-25/h1-6,15-17,25H,7-14H2,(H2,28,31)/t25-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]GR125743 from human 5HT1B expressed in LM(tk-) cells |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
D(2) dopamine receptor
(Rattus norvegicus (rat)) | BDBM50210641
((S)-1-(2-((S)-4-(6-fluoronaphthalen-2-yl)-2-methyl...)Show SMILES C[C@H]1CN(CCN1CC[C@@H]1OCCc2cc(ccc12)C(N)=O)c1ccc2cc(F)ccc2c1 Show InChI InChI=1S/C27H30FN3O2/c1-18-17-31(24-6-3-19-15-23(28)5-2-20(19)16-24)12-11-30(18)10-8-26-25-7-4-22(27(29)32)14-21(25)9-13-33-26/h2-7,14-16,18,26H,8-13,17H2,1H3,(H2,29,32)/t18-,26-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.17E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Lilly SA
Curated by ChEMBL
| Assay Description
Displacement of [3H]raclopride from dopamine D2 receptor in rat caudate membranes |
Bioorg Med Chem Lett 17: 3344-8 (2007)
Article DOI: 10.1016/j.bmcl.2007.03.101
BindingDB Entry DOI: 10.7270/Q20V8CG3 |
More data for this
Ligand-Target Pair | |
Search and Browse
