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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Solute carrier family 12 member 5' and Ligand = 'BDBM44176'   
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))
BDBM44176
PNG
(2-[5-(1H-Indol-3-yl)-[1,3,4]oxadiazol-2-ylsulfanyl...)
Show SMILES CC1CCCCN1C(=O)CSc1nnc(o1)-c1c[nH]c2ccccc12
Show InChI InChI=1S/C18H20N4O2S/c1-12-6-4-5-9-22(12)16(23)11-25-18-21-20-17(24-18)14-10-19-15-8-3-2-7-13(14)15/h2-3,7-8,10,12,19H,4-6,9,11H2,1H3
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PC cid
PC sid
UniChem

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PCBioAssay
n/an/an/an/a 1.52E+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))
BDBM44176
PNG
(2-[5-(1H-Indol-3-yl)-[1,3,4]oxadiazol-2-ylsulfanyl...)
Show SMILES CC1CCCCN1C(=O)CSc1nnc(o1)-c1c[nH]c2ccccc12
Show InChI InChI=1S/C18H20N4O2S/c1-12-6-4-5-9-22(12)16(23)11-25-18-21-20-17(24-18)14-10-19-15-8-3-2-7-13(14)15/h2-3,7-8,10,12,19H,4-6,9,11H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 1.07E+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