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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 = 'BDBM43929'   
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))
BDBM43929
PNG
(2-(1-Ethyl-1H-tetrazol-5-ylsulfanyl)-N-(4-thiophen...)
Show SMILES CCn1nnnc1SCC(=O)Nc1nc(cs1)-c1cccs1
Show InChI InChI=1S/C12H12N6OS3/c1-2-18-12(15-16-17-18)22-7-10(19)14-11-13-8(6-21-11)9-4-3-5-20-9/h3-6H,2,7H2,1H3,(H,13,14,19)
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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 1.32E+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))
BDBM43929
PNG
(2-(1-Ethyl-1H-tetrazol-5-ylsulfanyl)-N-(4-thiophen...)
Show SMILES CCn1nnnc1SCC(=O)Nc1nc(cs1)-c1cccs1
Show InChI InChI=1S/C12H12N6OS3/c1-2-18-12(15-16-17-18)22-7-10(19)14-11-13-8(6-21-11)9-4-3-5-20-9/h3-6H,2,7H2,1H3,(H,13,14,19)
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PC sid
UniChem
PCBioAssay
n/an/an/an/a 3.74E+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))
BDBM43929
PNG
(2-(1-Ethyl-1H-tetrazol-5-ylsulfanyl)-N-(4-thiophen...)
Show SMILES CCn1nnnc1SCC(=O)Nc1nc(cs1)-c1cccs1
Show InChI InChI=1S/C12H12N6OS3/c1-2-18-12(15-16-17-18)22-7-10(19)14-11-13-8(6-21-11)9-4-3-5-20-9/h3-6H,2,7H2,1H3,(H,13,14,19)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 1.97E+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