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PubMed code 23415083

Compile data set for download or QSAR
Found 13 hits of Enzyme Inhibition Constant Data   
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
AKT/p21CIP1


(Homo sapiens (human))
BDBM50431639
PNG
(CHEMBL2349075)
Show SMILES CCCCCCCCCCCCCCCC[C@]1(CCC[C@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC
Show InChI InChI=1S/C29H58NO6P/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-23-29(28(31)34-7-2)24-21-22-27(29)36-37(32,33)35-26-25-30(3,4)5/h27H,6-26H2,1-5H3/t27-,29-/m1/s1
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n/an/a 2.00E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of Akt phosphorylation in human insulin-stimulated A549 cells incubated for 2 hrs prior to insulin-induction measured after 30 mins by ELI...


Bioorg Med Chem 21: 2018-24 (2013)


Article DOI: 10.1016/j.bmc.2013.01.010
BindingDB Entry DOI: 10.7270/Q2NG4S1T
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50431633
PNG
(CHEMBL2349081)
Show SMILES CCCCCCCCCCCCCCCCCC[C@]1(CCC[C@@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC
Show InChI InChI=1S/C31H62NO6P/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-31(30(33)36-7-2)26-23-24-29(31)38-39(34,35)37-28-27-32(3,4)5/h29H,6-28H2,1-5H3/t29-,31+/m0/s1
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n/an/a 3.00E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of Akt phosphorylation in human insulin-stimulated A549 cells incubated for 2 hrs prior to insulin-induction measured after 30 mins by ELI...


Bioorg Med Chem 21: 2018-24 (2013)


Article DOI: 10.1016/j.bmc.2013.01.010
BindingDB Entry DOI: 10.7270/Q2NG4S1T
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50431640
PNG
(CHEMBL2349074)
Show SMILES CCCCCCCCCCCCC[C@]1(CCC[C@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC
Show InChI InChI=1S/C26H52NO6P/c1-6-8-9-10-11-12-13-14-15-16-17-20-26(25(28)31-7-2)21-18-19-24(26)33-34(29,30)32-23-22-27(3,4)5/h24H,6-23H2,1-5H3/t24-,26-/m1/s1
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n/an/a 3.10E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of Akt phosphorylation in human insulin-stimulated A549 cells incubated for 2 hrs prior to insulin-induction measured after 30 mins by ELI...


Bioorg Med Chem 21: 2018-24 (2013)


Article DOI: 10.1016/j.bmc.2013.01.010
BindingDB Entry DOI: 10.7270/Q2NG4S1T
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50011796
PNG
(1-octadecyl-2-methoxy-rac-glycero-3-phosphocholine...)
Show SMILES CCCCCCCCCCCCCCCCCCOCC(COP([O-])(=O)OCC[N+](C)(C)C)OC
Show InChI InChI=1S/C27H58NO6P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-32-25-27(31-5)26-34-35(29,30)33-24-22-28(2,3)4/h27H,6-26H2,1-5H3
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n/an/a 3.50E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of Akt phosphorylation in human insulin-stimulated A549 cells incubated for 2 hrs prior to insulin-induction measured after 30 mins by ELI...


Bioorg Med Chem 21: 2018-24 (2013)


Article DOI: 10.1016/j.bmc.2013.01.010
BindingDB Entry DOI: 10.7270/Q2NG4S1T
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50431634
PNG
(CHEMBL2349080)
Show SMILES CCCCCCCCCCCCCCCC[C@]1(CCC[C@@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC
Show InChI InChI=1S/C29H58NO6P/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-23-29(28(31)34-7-2)24-21-22-27(29)36-37(32,33)35-26-25-30(3,4)5/h27H,6-26H2,1-5H3/t27-,29+/m0/s1
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n/an/a 5.00E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of Akt phosphorylation in human insulin-stimulated A549 cells incubated for 2 hrs prior to insulin-induction measured after 30 mins by ELI...


Bioorg Med Chem 21: 2018-24 (2013)


Article DOI: 10.1016/j.bmc.2013.01.010
BindingDB Entry DOI: 10.7270/Q2NG4S1T
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50431630
PNG
(KRX-0401 | PERIFOSINE)
Show SMILES CCCCCCCCCCCCCCCCCCOP([O-])(=O)OC1CC[N+](C)(C)CC1
Show InChI InChI=1S/C25H52NO4P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-29-31(27,28)30-25-20-22-26(2,3)23-21-25/h25H,4-24H2,1-3H3
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n/an/a 5.30E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of Akt phosphorylation in human insulin-stimulated A549 cells incubated for 2 hrs prior to insulin-induction measured after 30 mins by ELI...


Bioorg Med Chem 21: 2018-24 (2013)


Article DOI: 10.1016/j.bmc.2013.01.010
BindingDB Entry DOI: 10.7270/Q2NG4S1T
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50431636
PNG
(CHEMBL2349078)
Show SMILES CCCCCCCCCCCCCCCCCCCCCC[C@]1(CCC[C@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC
Show InChI InChI=1S/C35H70NO6P/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-29-35(34(37)40-7-2)30-27-28-33(35)42-43(38,39)41-32-31-36(3,4)5/h33H,6-32H2,1-5H3/t33-,35-/m1/s1
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n/an/a 5.50E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of Akt phosphorylation in human insulin-stimulated A549 cells incubated for 2 hrs prior to insulin-induction measured after 30 mins by ELI...


Bioorg Med Chem 21: 2018-24 (2013)


Article DOI: 10.1016/j.bmc.2013.01.010
BindingDB Entry DOI: 10.7270/Q2NG4S1T
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50431635
PNG
(CHEMBL2349079)
Show SMILES CCCCCCCCCCCCC[C@]1(CCC[C@@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC
Show InChI InChI=1S/C26H52NO6P/c1-6-8-9-10-11-12-13-14-15-16-17-20-26(25(28)31-7-2)21-18-19-24(26)33-34(29,30)32-23-22-27(3,4)5/h24H,6-23H2,1-5H3/t24-,26+/m0/s1
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n/an/a 6.20E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of Akt phosphorylation in human insulin-stimulated A549 cells incubated for 2 hrs prior to insulin-induction measured after 30 mins by ELI...


Bioorg Med Chem 21: 2018-24 (2013)


Article DOI: 10.1016/j.bmc.2013.01.010
BindingDB Entry DOI: 10.7270/Q2NG4S1T
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50431632
PNG
(CHEMBL2349082)
Show SMILES CCCCCCCCCCCCCCCCCCCC[C@]1(CCC[C@@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC
Show InChI InChI=1S/C33H66NO6P/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27-33(32(35)38-7-2)28-25-26-31(33)40-41(36,37)39-30-29-34(3,4)5/h31H,6-30H2,1-5H3/t31-,33+/m0/s1
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n/an/a 6.90E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of Akt phosphorylation in human insulin-stimulated A549 cells incubated for 2 hrs prior to insulin-induction measured after 30 mins by ELI...


Bioorg Med Chem 21: 2018-24 (2013)


Article DOI: 10.1016/j.bmc.2013.01.010
BindingDB Entry DOI: 10.7270/Q2NG4S1T
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50431637
PNG
(CHEMBL2349077)
Show SMILES CCCCCCCCCCCCCCCCCCCC[C@]1(CCC[C@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC
Show InChI InChI=1S/C33H66NO6P/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27-33(32(35)38-7-2)28-25-26-31(33)40-41(36,37)39-30-29-34(3,4)5/h31H,6-30H2,1-5H3/t31-,33-/m1/s1
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n/an/a 7.00E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of Akt phosphorylation in human insulin-stimulated A549 cells incubated for 2 hrs prior to insulin-induction measured after 30 mins by ELI...


Bioorg Med Chem 21: 2018-24 (2013)


Article DOI: 10.1016/j.bmc.2013.01.010
BindingDB Entry DOI: 10.7270/Q2NG4S1T
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50034220
PNG
(2-(((Hexadecyloxy)hydroxyphosphinyl)oxy)-N,N,N-tri...)
Show SMILES CCCCCCCCCCCCCCCCOP([O-])(=O)OCC[N+](C)(C)C
Show InChI InChI=1S/C21H46NO4P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-25-27(23,24)26-21-19-22(2,3)4/h5-21H2,1-4H3
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n/an/a 9.60E+3n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of Akt phosphorylation in human insulin-stimulated A549 cells incubated for 2 hrs prior to insulin-induction measured after 30 mins by ELI...


Bioorg Med Chem 21: 2018-24 (2013)


Article DOI: 10.1016/j.bmc.2013.01.010
BindingDB Entry DOI: 10.7270/Q2NG4S1T
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50431638
PNG
(CHEMBL2349076)
Show SMILES CCCCCCCCCCCCCCCCCC[C@]1(CCC[C@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC
Show InChI InChI=1S/C31H62NO6P/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-31(30(33)36-7-2)26-23-24-29(31)38-39(34,35)37-28-27-32(3,4)5/h29H,6-28H2,1-5H3/t29-,31-/m1/s1
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n/an/a 1.09E+4n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of Akt phosphorylation in human insulin-stimulated A549 cells incubated for 2 hrs prior to insulin-induction measured after 30 mins by ELI...


Bioorg Med Chem 21: 2018-24 (2013)


Article DOI: 10.1016/j.bmc.2013.01.010
BindingDB Entry DOI: 10.7270/Q2NG4S1T
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50431631
PNG
(CHEMBL2349083)
Show SMILES CCCCCCCCCCCCCCCCCCCCCC[C@]1(CCC[C@@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC
Show InChI InChI=1S/C35H70NO6P/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-29-35(34(37)40-7-2)30-27-28-33(35)42-43(38,39)41-32-31-36(3,4)5/h33H,6-32H2,1-5H3/t33-,35+/m0/s1
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n/an/a 1.91E+4n/an/an/an/an/an/a



Kyung Hee University

Curated by ChEMBL


Assay Description
Inhibition of Akt phosphorylation in human insulin-stimulated A549 cells incubated for 2 hrs prior to insulin-induction measured after 30 mins by ELI...


Bioorg Med Chem 21: 2018-24 (2013)


Article DOI: 10.1016/j.bmc.2013.01.010
BindingDB Entry DOI: 10.7270/Q2NG4S1T
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%