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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 = 'BDBM43939'   
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))
BDBM43939
PNG
(2-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanyl-1-(3,4...)
Show SMILES Clc1ccc(cc1)-n1nnnc1SCC(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C18H16ClN5OS/c19-15-5-7-16(8-6-15)24-18(20-21-22-24)26-12-17(25)23-10-9-13-3-1-2-4-14(13)11-23/h1-8H,9-12H2
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PC sid
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PCBioAssay
n/an/an/an/a 4.09E+3n/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
Solute carrier family 12 member 5


(Homo sapiens (Human))
BDBM43939
PNG
(2-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanyl-1-(3,4...)
Show SMILES Clc1ccc(cc1)-n1nnnc1SCC(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C18H16ClN5OS/c19-15-5-7-16(8-6-15)24-18(20-21-22-24)26-12-17(25)23-10-9-13-3-1-2-4-14(13)11-23/h1-8H,9-12H2
PDB

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n/an/an/an/a 1.42E+3n/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))
BDBM43939
PNG
(2-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanyl-1-(3,4...)
Show SMILES Clc1ccc(cc1)-n1nnnc1SCC(=O)N1CCc2ccccc2C1
Show InChI InChI=1S/C18H16ClN5OS/c19-15-5-7-16(8-6-15)24-18(20-21-22-24)26-12-17(25)23-10-9-13-3-1-2-4-14(13)11-23/h1-8H,9-12H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem

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PCBioAssay
n/an/an/an/a 3.26E+3n/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