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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'RAC-alpha serine/threonine-protein kinase' and Ligand = 'BDBM369778'   
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
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM369778
PNG
(US10233160, Compound 69 | US9981925, Compound 69)
Show SMILES NC(=O)c1ccnc2c(N[C@H](CN3CC(F)C3)c3ccc(Cl)c(c3)C(F)(F)F)ncnc12 |r|
Show InChI InChI=1S/C20H17ClF4N6O/c21-14-2-1-10(5-13(14)20(23,24)25)15(8-31-6-11(22)7-31)30-19-17-16(28-9-29-19)12(18(26)32)3-4-27-17/h1-5,9,11,15H,6-8H2,(H2,26,32)(H,28,29,30)/t15-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 62n/an/an/an/an/an/a



University of Athens



Assay Description
In order to measure AKT inhibition in the Caliper Life Sciences LC3000, a TTP Mosquito liquid handling instrument was used to place 125 nl of the app...


J Med Chem 51: 2216-2226 (2008)


BindingDB Entry DOI: 10.7270/Q27H1MWF
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM369778
PNG
(US10233160, Compound 69 | US9981925, Compound 69)
Show SMILES NC(=O)c1ccnc2c(N[C@H](CN3CC(F)C3)c3ccc(Cl)c(c3)C(F)(F)F)ncnc12 |r|
Show InChI InChI=1S/C20H17ClF4N6O/c21-14-2-1-10(5-13(14)20(23,24)25)15(8-31-6-11(22)7-31)30-19-17-16(28-9-29-19)12(18(26)32)3-4-27-17/h1-5,9,11,15H,6-8H2,(H2,26,32)(H,28,29,30)/t15-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 62.5n/an/an/an/an/an/a



Anadys Pharmaceuticals



Assay Description
In order to measure AKT inhibition in the Caliper Life Sciences LC3000, a TTP Mosquito liquid handling instrument was used to place 125 nl of the app...


Bioorg Med Chem Lett 18: 4181-5 (2008)


BindingDB Entry DOI: 10.7270/Q2319Z6K
More data for this
Ligand-Target Pair