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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase Sgk1' and Ligand = 'BDBM268719'   
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
Serine/threonine-protein kinase Sgk1


(Homo sapiens (Human))
BDBM268719
PNG
(US9718825, Example 121 | US9718825, Example 122)
Show SMILES Cc1ccc(F)c(c1)S(=O)(=O)Nc1ccc(cc1)-c1nc(OCc2cn[nH]c2)c2cn[nH]c2n1
Show InChI InChI=1S/C22H18FN7O3S/c1-13-2-7-18(23)19(8-13)34(31,32)30-16-5-3-15(4-6-16)20-27-21-17(11-26-29-21)22(28-20)33-12-14-9-24-25-10-14/h2-11,30H,12H2,1H3,(H,24,25)(H,26,27,28,29)
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PC cid
PC sid
UniChem
US Patent
n/an/a<1.5n/an/an/an/a7.4n/a



SANOFI

US Patent


Assay Description
The compounds were tested for serum and glucocorticoid-regulated kinase 1 (SGK-1) inhibitory activity in a substrate phosphorylation assay designed t...


US Patent US9718825 (2017)


BindingDB Entry DOI: 10.7270/Q2VM4F82
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Sgk1


(Homo sapiens (Human))
BDBM268719
PNG
(US9718825, Example 121 | US9718825, Example 122)
Show SMILES Cc1ccc(F)c(c1)S(=O)(=O)Nc1ccc(cc1)-c1nc(OCc2cn[nH]c2)c2cn[nH]c2n1
Show InChI InChI=1S/C22H18FN7O3S/c1-13-2-7-18(23)19(8-13)34(31,32)30-16-5-3-15(4-6-16)20-27-21-17(11-26-29-21)22(28-20)33-12-14-9-24-25-10-14/h2-11,30H,12H2,1H3,(H,24,25)(H,26,27,28,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<1.5n/an/an/an/a7.4n/a



SANOFI

US Patent


Assay Description
The compounds were tested for serum and glucocorticoid-regulated kinase 1 (SGK-1) inhibitory activity in a substrate phosphorylation assay designed t...


US Patent US9718825 (2017)


BindingDB Entry DOI: 10.7270/Q2VM4F82
More data for this
Ligand-Target Pair