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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 = 'BDBM104447'   
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))
BDBM104447
PNG
(US8575186, 210/211 | US8575186, 227)
Show SMILES Cn1c2CC3CCC(N3)c2c2cc(cc(O)c12)S(=O)(=O)c1ccccc1F |THB:10:9:8:6.5,1:2:8:6.5|
Show InChI InChI=1S/C20H19FN2O3S/c1-23-16-8-11-6-7-15(22-11)19(16)13-9-12(10-17(24)20(13)23)27(25,26)18-5-3-2-4-14(18)21/h2-5,9-11,15,22,24H,6-8H2,1H3
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PC cid
PC sid
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Similars

US Patent
1n/an/an/an/an/an/an/an/a



Albany Molecular Research, Inc.

US Patent


Assay Description
The relative affinities of the various compounds for the 5-HT6 receptor were measured in a radioligand binding assay, using a sintillation proximity ...


US Patent US8575186 (2013)


BindingDB Entry DOI: 10.7270/Q2BR8QTS
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM104447
PNG
(US8575186, 210/211 | US8575186, 227)
Show SMILES Cn1c2CC3CCC(N3)c2c2cc(cc(O)c12)S(=O)(=O)c1ccccc1F |THB:10:9:8:6.5,1:2:8:6.5|
Show InChI InChI=1S/C20H19FN2O3S/c1-23-16-8-11-6-7-15(22-11)19(16)13-9-12(10-17(24)20(13)23)27(25,26)18-5-3-2-4-14(18)21/h2-5,9-11,15,22,24H,6-8H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
1.60n/an/an/an/an/an/an/an/a



Albany Molecular Research, Inc.

US Patent


Assay Description
The relative affinities of the various compounds for the 5-HT6 receptor were measured in a radioligand binding assay, using a sintillation proximity ...


US Patent US8575186 (2013)


BindingDB Entry DOI: 10.7270/Q2BR8QTS
More data for this
Ligand-Target Pair