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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 7' and Ligand = 'BDBM85609'   
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 7


(Homo sapiens (Human))
BDBM85609
PNG
((R)-1-(2-(1-(3-methoxy-benzenesulfonyl)-pyrrolidin...)
Show SMILES [#6]-[#8]-c1cccc(c1)[S;v6](=O)(=O)[#7]-1-[#6]-[#6]-[#6]-[#6@@H]-1-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#6](-[#6])-[#6]-[#6]-1
Show InChI InChI=1S/C19H30N2O3S/c1-16-8-12-20(13-9-16)14-10-17-5-4-11-21(17)25(22,23)19-7-3-6-18(15-19)24-2/h3,6-7,15-17H,4-5,8-14H2,1-2H3/t17-/m1/s1
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Similars

Article
PubMed
10n/an/an/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by PDSP Ki Database




J Med Chem 43: 342-5 (2000)


Article DOI: 10.1021/jm991151j
BindingDB Entry DOI: 10.7270/Q28S4NGP
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM85609
PNG
((R)-1-(2-(1-(3-methoxy-benzenesulfonyl)-pyrrolidin...)
Show SMILES [#6]-[#8]-c1cccc(c1)[S;v6](=O)(=O)[#7]-1-[#6]-[#6]-[#6]-[#6@@H]-1-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#6](-[#6])-[#6]-[#6]-1
Show InChI InChI=1S/C19H30N2O3S/c1-16-8-12-20(13-9-16)14-10-17-5-4-11-21(17)25(22,23)19-7-3-6-18(15-19)24-2/h3,6-7,15-17H,4-5,8-14H2,1-2H3/t17-/m1/s1
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UniProtKB/SwissProt

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antibodypedia
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PC sid
UniChem

Similars

Article
PubMed
18n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00633
BindingDB Entry DOI: 10.7270/Q26M3BS8
More data for this
Ligand-Target Pair