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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Solute carrier family 12 member 5' and Ligand = 'BDBM43958'   
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
Solute carrier family 12 member 5


(Homo sapiens (Human))
BDBM43958
PNG
(2-{[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidi...)
Show SMILES O=C(C1CCN(CC1)S(=O)(=O)c1cccc2nsnc12)N1CCc2ccccc2C1
Show InChI InChI=1S/C21H22N4O3S2/c26-21(24-11-8-15-4-1-2-5-17(15)14-24)16-9-12-25(13-10-16)30(27,28)19-7-3-6-18-20(19)23-29-22-18/h1-7,16H,8-14H2
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n/an/an/an/a 3.41E+4n/an/an/an/a



Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters

Curated by PubChem BioAssay


Assay Description
Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters Assay Provider: Eric Delpire Assay Provider Affliation: Vanderbilt University Gr...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2Q52N1X
More data for this
Ligand-Target Pair
Solute carrier family 12 member 5


(Homo sapiens (Human))
BDBM43958
PNG
(2-{[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidi...)
Show SMILES O=C(C1CCN(CC1)S(=O)(=O)c1cccc2nsnc12)N1CCc2ccccc2C1
Show InChI InChI=1S/C21H22N4O3S2/c26-21(24-11-8-15-4-1-2-5-17(15)14-24)16-9-12-25(13-10-16)30(27,28)19-7-3-6-18-20(19)23-29-22-18/h1-7,16H,8-14H2
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PC cid
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PCBioAssay
n/an/an/an/a 2.38E+4n/an/an/an/a



Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters

Curated by PubChem BioAssay


Assay Description
Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters Assay Provider: Eric Delpire Assay Provider Affliation: Vanderbilt University Gr...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2M32T6M
More data for this
Ligand-Target Pair
Solute carrier family 12 member 5


(Homo sapiens (Human))
BDBM43958
PNG
(2-{[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidi...)
Show SMILES O=C(C1CCN(CC1)S(=O)(=O)c1cccc2nsnc12)N1CCc2ccccc2C1
Show InChI InChI=1S/C21H22N4O3S2/c26-21(24-11-8-15-4-1-2-5-17(15)14-24)16-9-12-25(13-10-16)30(27,28)19-7-3-6-18-20(19)23-29-22-18/h1-7,16H,8-14H2
PDB

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KEGG

UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 6.97E+4n/an/an/an/a



Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters

Curated by PubChem BioAssay


Assay Description
Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters Assay Provider: Eric Delpire Assay Provider Affliation: Vanderbilt University Gr...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2TX3CSC
More data for this
Ligand-Target Pair