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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 6' and Ligand = 'BDBM50172284'   
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
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50172284
PNG
(4-[3-((S)-1-Methyl-pyrrolidin-2-ylmethyl)-indole-1...)
Show SMILES CN1CCC[C@H]1Cc1cn(c2ccccc12)S(=O)(=O)c1ccc(N)cc1
Show InChI InChI=1S/C20H23N3O2S/c1-22-12-4-5-17(22)13-15-14-23(20-7-3-2-6-19(15)20)26(24,25)18-10-8-16(21)9-11-18/h2-3,6-11,14,17H,4-5,12-13,21H2,1H3/t17-/m0/s1
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PC cid
PC sid
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Article
PubMed
3n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from cloned human 5-hydroxytryptamine 6 receptor expressed in HeLa cells


Bioorg Med Chem Lett 15: 4780-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.028
BindingDB Entry DOI: 10.7270/Q2RN37DD
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50172284
PNG
(4-[3-((S)-1-Methyl-pyrrolidin-2-ylmethyl)-indole-1...)
Show SMILES CN1CCC[C@H]1Cc1cn(c2ccccc12)S(=O)(=O)c1ccc(N)cc1
Show InChI InChI=1S/C20H23N3O2S/c1-22-12-4-5-17(22)13-15-14-23(20-7-3-2-6-19(15)20)26(24,25)18-10-8-16(21)9-11-18/h2-3,6-11,14,17H,4-5,12-13,21H2,1H3/t17-/m0/s1
PDB

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KEGG

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antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 24.5n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of cAMP production in HeLa cells expressing human 5-HT6 receptor


Bioorg Med Chem Lett 15: 4780-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.028
BindingDB Entry DOI: 10.7270/Q2RN37DD
More data for this
Ligand-Target Pair