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PubMed code 18539456

Compile data set for download or QSAR
Found 106 hits of Enzyme Inhibition Constant Data   
Target
(Institution)
LigandTarget
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))
BDBM50243780
PNG
(2-(dimethylamino)-1-(4-(6-phenyl-7-(4-((4-(5-(pyri...)
Show SMILES CN(C)CC(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C40H43N11O/c1-48(2)27-35(52)50-20-22-51(23-21-50)40-42-25-32-24-33(29-8-4-3-5-9-29)36(43-37(32)45-40)30-13-11-28(12-14-30)26-49-18-15-31(16-19-49)38-44-39(47-46-38)34-10-6-7-17-41-34/h3-14,17,24-25,31H,15-16,18-23,26-27H2,1-2H3,(H,44,46,47)
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n/an/a 3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243216
PNG
(CHEMBL443661 | N,N-dimethyl-2-(4-(6-phenyl-7-(4-((...)
Show SMILES CN(C)CCN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C40H45N11/c1-48(2)20-21-49-22-24-51(25-23-49)40-42-27-33-26-34(30-8-4-3-5-9-30)36(43-37(33)45-40)31-13-11-29(12-14-31)28-50-18-15-32(16-19-50)38-44-39(47-46-38)35-10-6-7-17-41-35/h3-14,17,26-27,32H,15-16,18-25,28H2,1-2H3,(H,44,46,47)
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n/an/a 4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243216
PNG
(CHEMBL443661 | N,N-dimethyl-2-(4-(6-phenyl-7-(4-((...)
Show SMILES CN(C)CCN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C40H45N11/c1-48(2)20-21-49-22-24-51(25-23-49)40-42-27-33-26-34(30-8-4-3-5-9-30)36(43-37(33)45-40)31-13-11-29(12-14-31)28-50-18-15-32(16-19-50)38-44-39(47-46-38)35-10-6-7-17-41-35/h3-14,17,26-27,32H,15-16,18-25,28H2,1-2H3,(H,44,46,47)
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n/an/a 4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243777
PNG
(1-(4-(6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4H-1,2,4...)
Show SMILES CC(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H38N10O/c1-26(49)47-19-21-48(22-20-47)38-40-24-31-23-32(28-7-3-2-4-8-28)34(41-35(31)43-38)29-12-10-27(11-13-29)25-46-17-14-30(15-18-46)36-42-37(45-44-36)33-9-5-6-16-39-33/h2-13,16,23-24,30H,14-15,17-22,25H2,1H3,(H,42,44,45)
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n/an/a 5n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243764
PNG
(2-morpholino-6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4...)
Show SMILES C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)N1CCOCC1
Show InChI InChI=1S/C36H35N9O/c1-2-6-26(7-3-1)30-22-29-23-38-36(45-18-20-46-21-19-45)41-33(29)39-32(30)27-11-9-25(10-12-27)24-44-16-13-28(14-17-44)34-40-35(43-42-34)31-8-4-5-15-37-31/h1-12,15,22-23,28H,13-14,16-21,24H2,(H,40,42,43)
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n/an/a 5n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243776
PNG
(2-(1H-imidazol-1-yl)-6-phenyl-7-(4-((4-(5-(pyridin...)
Show SMILES C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)-n1ccnc1
Show InChI InChI=1S/C35H30N10/c1-2-6-25(7-3-1)29-20-28-21-38-35(45-19-16-36-23-45)41-32(28)39-31(29)26-11-9-24(10-12-26)22-44-17-13-27(14-18-44)33-40-34(43-42-33)30-8-4-5-15-37-30/h1-12,15-16,19-21,23,27H,13-14,17-18,22H2,(H,40,42,43)
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n/an/a 5n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243783
PNG
(2-(4-(1-methylazetidin-3-yl)piperazin-1-yl)-6-phen...)
Show SMILES CN1CC(C1)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C40H43N11/c1-48-26-33(27-48)50-19-21-51(22-20-50)40-42-24-32-23-34(29-7-3-2-4-8-29)36(43-37(32)45-40)30-12-10-28(11-13-30)25-49-17-14-31(15-18-49)38-44-39(47-46-38)35-9-5-6-16-41-35/h2-13,16,23-24,31,33H,14-15,17-22,25-27H2,1H3,(H,44,46,47)
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n/an/a 6n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243780
PNG
(2-(dimethylamino)-1-(4-(6-phenyl-7-(4-((4-(5-(pyri...)
Show SMILES CN(C)CC(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C40H43N11O/c1-48(2)27-35(52)50-20-22-51(23-21-50)40-42-25-32-24-33(29-8-4-3-5-9-29)36(43-37(32)45-40)30-13-11-28(12-14-30)26-49-18-15-31(16-19-49)38-44-39(47-46-38)34-10-6-7-17-41-34/h3-14,17,24-25,31H,15-16,18-23,26-27H2,1-2H3,(H,44,46,47)
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n/an/a 6n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM24880
PNG
(CHEMBL252857 | N-methyl-6-phenyl-7-[4-({4-[5-(pyri...)
Show SMILES CNc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C33H31N9/c1-34-33-36-20-26-19-27(23-7-3-2-4-8-23)29(37-30(26)39-33)24-12-10-22(11-13-24)21-42-17-14-25(15-18-42)31-38-32(41-40-31)28-9-5-6-16-35-28/h2-13,16,19-20,25H,14-15,17-18,21H2,1H3,(H,38,40,41)(H,34,36,37,39)
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n/an/a 6n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243780
PNG
(2-(dimethylamino)-1-(4-(6-phenyl-7-(4-((4-(5-(pyri...)
Show SMILES CN(C)CC(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C40H43N11O/c1-48(2)27-35(52)50-20-22-51(23-21-50)40-42-25-32-24-33(29-8-4-3-5-9-29)36(43-37(32)45-40)30-13-11-28(12-14-30)26-49-18-15-31(16-19-49)38-44-39(47-46-38)34-10-6-7-17-41-34/h3-14,17,24-25,31H,15-16,18-23,26-27H2,1-2H3,(H,44,46,47)
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n/an/a 6n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243765
PNG
(1-(6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4H-1,2,4-tr...)
Show SMILES OC1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H37N9O/c47-30-15-20-46(21-16-30)37-39-23-29-22-31(26-6-2-1-3-7-26)33(40-34(29)42-37)27-11-9-25(10-12-27)24-45-18-13-28(14-19-45)35-41-36(44-43-35)32-8-4-5-17-38-32/h1-12,17,22-23,28,30,47H,13-16,18-21,24H2,(H,41,43,44)
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n/an/a 7n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243778
PNG
(2-(4-(methylsulfonyl)piperazin-1-yl)-6-phenyl-7-(4...)
Show SMILES CS(=O)(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H38N10O2S/c1-50(48,49)47-21-19-46(20-22-47)37-39-24-30-23-31(27-7-3-2-4-8-27)33(40-34(30)42-37)28-12-10-26(11-13-28)25-45-17-14-29(15-18-45)35-41-36(44-43-35)32-9-5-6-16-38-32/h2-13,16,23-24,29H,14-15,17-22,25H2,1H3,(H,41,43,44)
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n/an/a 7n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243769
PNG
(2-((R)-3-methylpiperazin-1-yl)-6-phenyl-7-(4-((4-(...)
Show SMILES C[C@@H]1CN(CCN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H38N10/c1-25-23-47(20-17-38-25)37-40-22-30-21-31(27-7-3-2-4-8-27)33(41-34(30)43-37)28-12-10-26(11-13-28)24-46-18-14-29(15-19-46)35-42-36(45-44-35)32-9-5-6-16-39-32/h2-13,16,21-22,25,29,38H,14-15,17-20,23-24H2,1H3,(H,42,44,45)/t25-/m1/s1
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n/an/a 8n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243782
PNG
(2-(4-(6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4H-1,2,4...)
Show SMILES OCCN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H40N10O/c49-23-22-46-18-20-48(21-19-46)38-40-25-31-24-32(28-6-2-1-3-7-28)34(41-35(31)43-38)29-11-9-27(10-12-29)26-47-16-13-30(14-17-47)36-42-37(45-44-36)33-8-4-5-15-39-33/h1-12,15,24-25,30,49H,13-14,16-23,26H2,(H,42,44,45)
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n/an/a 9n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243783
PNG
(2-(4-(1-methylazetidin-3-yl)piperazin-1-yl)-6-phen...)
Show SMILES CN1CC(C1)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C40H43N11/c1-48-26-33(27-48)50-19-21-51(22-20-50)40-42-24-32-23-34(29-7-3-2-4-8-29)36(43-37(32)45-40)30-12-10-28(11-13-30)25-49-17-14-31(15-18-49)38-44-39(47-46-38)35-9-5-6-16-41-35/h2-13,16,23-24,31,33H,14-15,17-22,25-27H2,1H3,(H,44,46,47)
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n/an/a 9n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243771
PNG
(2-(4-methylpiperazin-1-yl)-6-phenyl-7-(4-((4-(5-(p...)
Show SMILES CN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H38N10/c1-45-19-21-47(22-20-45)37-39-24-30-23-31(27-7-3-2-4-8-27)33(40-34(30)42-37)28-12-10-26(11-13-28)25-46-17-14-29(15-18-46)35-41-36(44-43-35)32-9-5-6-16-38-32/h2-13,16,23-24,29H,14-15,17-22,25H2,1H3,(H,41,43,44)
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n/an/a 9n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243216
PNG
(CHEMBL443661 | N,N-dimethyl-2-(4-(6-phenyl-7-(4-((...)
Show SMILES CN(C)CCN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C40H45N11/c1-48(2)20-21-49-22-24-51(25-23-49)40-42-27-33-26-34(30-8-4-3-5-9-30)36(43-37(33)45-40)31-13-11-29(12-14-31)28-50-18-15-32(16-19-50)38-44-39(47-46-38)35-10-6-7-17-41-35/h3-14,17,26-27,32H,15-16,18-25,28H2,1-2H3,(H,44,46,47)
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n/an/a 10n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243775
PNG
(CHEMBL454859 | N,N-dimethyl-1-(6-phenyl-7-(4-((4-(...)
Show SMILES CN(C)C1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C39H42N10/c1-47(2)32-17-22-49(23-18-32)39-41-25-31-24-33(28-8-4-3-5-9-28)35(42-36(31)44-39)29-13-11-27(12-14-29)26-48-20-15-30(16-21-48)37-43-38(46-45-37)34-10-6-7-19-40-34/h3-14,19,24-25,30,32H,15-18,20-23,26H2,1-2H3,(H,43,45,46)
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n/an/a 10n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243783
PNG
(2-(4-(1-methylazetidin-3-yl)piperazin-1-yl)-6-phen...)
Show SMILES CN1CC(C1)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C40H43N11/c1-48-26-33(27-48)50-19-21-51(22-20-50)40-42-24-32-23-34(29-7-3-2-4-8-29)36(43-37(32)45-40)30-12-10-28(11-13-30)25-49-17-14-31(15-18-49)38-44-39(47-46-38)35-9-5-6-16-41-35/h2-13,16,23-24,31,33H,14-15,17-22,25-27H2,1H3,(H,44,46,47)
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n/an/a 12n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243779
PNG
(CHEMBL447348 | N,N-dimethyl-4-(6-phenyl-7-(4-((4-(...)
Show SMILES CN(C)C(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C39H41N11O/c1-47(2)39(51)50-22-20-49(21-23-50)38-41-25-31-24-32(28-8-4-3-5-9-28)34(42-35(31)44-38)29-13-11-27(12-14-29)26-48-18-15-30(16-19-48)36-43-37(46-45-36)33-10-6-7-17-40-33/h3-14,17,24-25,30H,15-16,18-23,26H2,1-2H3,(H,43,45,46)
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n/an/a 13n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243777
PNG
(1-(4-(6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4H-1,2,4...)
Show SMILES CC(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H38N10O/c1-26(49)47-19-21-48(22-20-47)38-40-24-31-23-32(28-7-3-2-4-8-28)34(41-35(31)43-38)29-12-10-27(11-13-29)25-46-17-14-30(15-18-46)36-42-37(45-44-36)33-9-5-6-16-39-33/h2-13,16,23-24,30H,14-15,17-22,25H2,1H3,(H,42,44,45)
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n/an/a 15n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM24867
PNG
(1-(2-aminophenyl)-3-[({4-[2-(methylsulfanyl)-6-phe...)
Show SMILES CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CNCCC(=O)c2ccccc2N)cc1
Show InChI InChI=1S/C30H27N5OS/c1-37-30-33-19-23-17-25(21-7-3-2-4-8-21)28(34-29(23)35-30)22-13-11-20(12-14-22)18-32-16-15-27(36)24-9-5-6-10-26(24)31/h2-14,17,19,32H,15-16,18,31H2,1H3
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n/an/a 15n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243777
PNG
(1-(4-(6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4H-1,2,4...)
Show SMILES CC(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H38N10O/c1-26(49)47-19-21-48(22-20-47)38-40-24-31-23-32(28-7-3-2-4-8-28)34(41-35(31)43-38)29-12-10-27(11-13-29)25-46-17-14-30(15-18-46)36-42-37(45-44-36)33-9-5-6-16-39-33/h2-13,16,23-24,30H,14-15,17-22,25H2,1H3,(H,42,44,45)
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n/an/a 16n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243782
PNG
(2-(4-(6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4H-1,2,4...)
Show SMILES OCCN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H40N10O/c49-23-22-46-18-20-48(21-19-46)38-40-25-31-24-32(28-6-2-1-3-7-28)34(41-35(31)43-38)29-11-9-27(10-12-29)26-47-16-13-30(14-17-47)36-42-37(45-44-36)33-8-4-5-15-39-33/h1-12,15,24-25,30,49H,13-14,16-23,26H2,(H,42,44,45)
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n/an/a 17n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243770
PNG
(2-((S)-3-methylpiperazin-1-yl)-6-phenyl-7-(4-((4-(...)
Show SMILES C[C@H]1CN(CCN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H38N10/c1-25-23-47(20-17-38-25)37-40-22-30-21-31(27-7-3-2-4-8-27)33(41-34(30)43-37)28-12-10-26(11-13-28)24-46-18-14-29(15-19-46)35-42-36(45-44-35)32-9-5-6-16-39-32/h2-13,16,21-22,25,29,38H,14-15,17-20,23-24H2,1H3,(H,42,44,45)/t25-/m0/s1
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n/an/a 17n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243765
PNG
(1-(6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4H-1,2,4-tr...)
Show SMILES OC1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H37N9O/c47-30-15-20-46(21-16-30)37-39-23-29-22-31(26-6-2-1-3-7-26)33(40-34(29)42-37)27-11-9-25(10-12-27)24-45-18-13-28(14-19-45)35-41-36(44-43-35)32-8-4-5-17-38-32/h1-12,17,22-23,28,30,47H,13-16,18-21,24H2,(H,41,43,44)
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n/an/a 17n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243763
PNG
(6-phenyl-2-(piperidin-1-yl)-7-(4-((4-(5-(pyridin-2...)
Show SMILES C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)N1CCCCC1
Show InChI InChI=1S/C37H37N9/c1-3-9-27(10-4-1)31-23-30-24-39-37(46-19-7-2-8-20-46)42-34(30)40-33(31)28-14-12-26(13-15-28)25-45-21-16-29(17-22-45)35-41-36(44-43-35)32-11-5-6-18-38-32/h1,3-6,9-15,18,23-24,29H,2,7-8,16-17,19-22,25H2,(H,41,43,44)
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n/an/a 18n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243779
PNG
(CHEMBL447348 | N,N-dimethyl-4-(6-phenyl-7-(4-((4-(...)
Show SMILES CN(C)C(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C39H41N11O/c1-47(2)39(51)50-22-20-49(21-23-50)38-41-25-31-24-32(28-8-4-3-5-9-28)34(42-35(31)44-38)29-13-11-27(12-14-29)26-48-18-15-30(16-19-48)36-43-37(46-45-36)33-10-6-7-17-40-33/h3-14,17,24-25,30H,15-16,18-23,26H2,1-2H3,(H,43,45,46)
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n/an/a 18n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243781
PNG
(2-(5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazin-7(8H)...)
Show SMILES C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)N1CCn2cnnc2C1
Show InChI InChI=1S/C37H34N12/c1-2-6-26(7-3-1)30-20-29-21-39-37(48-18-19-49-24-40-44-32(49)23-48)43-34(29)41-33(30)27-11-9-25(10-12-27)22-47-16-13-28(14-17-47)35-42-36(46-45-35)31-8-4-5-15-38-31/h1-12,15,20-21,24,28H,13-14,16-19,22-23H2,(H,42,45,46)
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n/an/a 19n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243780
PNG
(2-(dimethylamino)-1-(4-(6-phenyl-7-(4-((4-(5-(pyri...)
Show SMILES CN(C)CC(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C40H43N11O/c1-48(2)27-35(52)50-20-22-51(23-21-50)40-42-25-32-24-33(29-8-4-3-5-9-29)36(43-37(32)45-40)30-13-11-28(12-14-30)26-49-18-15-31(16-19-49)38-44-39(47-46-38)34-10-6-7-17-41-34/h3-14,17,24-25,31H,15-16,18-23,26-27H2,1-2H3,(H,44,46,47)
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n/an/a 19n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243764
PNG
(2-morpholino-6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4...)
Show SMILES C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)N1CCOCC1
Show InChI InChI=1S/C36H35N9O/c1-2-6-26(7-3-1)30-22-29-23-38-36(45-18-20-46-21-19-45)41-33(29)39-32(30)27-11-9-25(10-12-27)24-44-16-13-28(14-17-44)34-40-35(43-42-34)31-8-4-5-15-37-31/h1-12,15,22-23,28H,13-14,16-21,24H2,(H,40,42,43)
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n/an/a 19n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243778
PNG
(2-(4-(methylsulfonyl)piperazin-1-yl)-6-phenyl-7-(4...)
Show SMILES CS(=O)(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H38N10O2S/c1-50(48,49)47-21-19-46(20-22-47)37-39-24-30-23-31(27-7-3-2-4-8-27)33(40-34(30)42-37)28-12-10-26(11-13-28)25-45-17-14-29(15-18-45)35-41-36(44-43-35)32-9-5-6-16-38-32/h2-13,16,23-24,29H,14-15,17-22,25H2,1H3,(H,41,43,44)
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n/an/a 20n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM24880
PNG
(CHEMBL252857 | N-methyl-6-phenyl-7-[4-({4-[5-(pyri...)
Show SMILES CNc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C33H31N9/c1-34-33-36-20-26-19-27(23-7-3-2-4-8-23)29(37-30(26)39-33)24-12-10-22(11-13-24)21-42-17-14-25(15-18-42)31-38-32(41-40-31)28-9-5-6-16-35-28/h2-13,16,19-20,25H,14-15,17-18,21H2,1H3,(H,38,40,41)(H,34,36,37,39)
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n/an/a 20n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243762
PNG
(2-(3,3-difluoropyrrolidin-1-yl)-6-phenyl-7-(4-((4-...)
Show SMILES FC1(F)CCN(C1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C36H33F2N9/c37-36(38)15-19-47(23-36)35-40-21-28-20-29(25-6-2-1-3-7-25)31(41-32(28)43-35)26-11-9-24(10-12-26)22-46-17-13-27(14-18-46)33-42-34(45-44-33)30-8-4-5-16-39-30/h1-12,16,20-21,27H,13-15,17-19,22-23H2,(H,42,44,45)
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n/an/a 20n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243775
PNG
(CHEMBL454859 | N,N-dimethyl-1-(6-phenyl-7-(4-((4-(...)
Show SMILES CN(C)C1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C39H42N10/c1-47(2)32-17-22-49(23-18-32)39-41-25-31-24-33(28-8-4-3-5-9-28)35(42-36(31)44-39)29-13-11-27(12-14-29)26-48-20-15-30(16-21-48)37-43-38(46-45-37)34-10-6-7-19-40-34/h3-14,19,24-25,30,32H,15-18,20-23,26H2,1-2H3,(H,43,45,46)
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n/an/a 22n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243778
PNG
(2-(4-(methylsulfonyl)piperazin-1-yl)-6-phenyl-7-(4...)
Show SMILES CS(=O)(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H38N10O2S/c1-50(48,49)47-21-19-46(20-22-47)37-39-24-30-23-31(27-7-3-2-4-8-27)33(40-34(30)42-37)28-12-10-26(11-13-28)25-45-17-14-29(15-18-45)35-41-36(44-43-35)32-9-5-6-16-38-32/h2-13,16,23-24,29H,14-15,17-22,25H2,1H3,(H,41,43,44)
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n/an/a 23n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243775
PNG
(CHEMBL454859 | N,N-dimethyl-1-(6-phenyl-7-(4-((4-(...)
Show SMILES CN(C)C1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C39H42N10/c1-47(2)32-17-22-49(23-18-32)39-41-25-31-24-33(28-8-4-3-5-9-28)35(42-36(31)44-39)29-13-11-27(12-14-29)26-48-20-15-30(16-21-48)37-43-38(46-45-37)34-10-6-7-19-40-34/h3-14,19,24-25,30,32H,15-18,20-23,26H2,1-2H3,(H,43,45,46)
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n/an/a 23n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243769
PNG
(2-((R)-3-methylpiperazin-1-yl)-6-phenyl-7-(4-((4-(...)
Show SMILES C[C@@H]1CN(CCN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H38N10/c1-25-23-47(20-17-38-25)37-40-22-30-21-31(27-7-3-2-4-8-27)33(41-34(30)43-37)28-12-10-26(11-13-28)24-46-18-14-29(15-19-46)35-42-36(45-44-35)32-9-5-6-16-39-32/h2-13,16,21-22,25,29,38H,14-15,17-20,23-24H2,1H3,(H,42,44,45)/t25-/m1/s1
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n/an/a 25n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243774
PNG
((2R)-4-(6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4H-1,2...)
Show SMILES O[C@@H]1CN(CCN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C36H36N10O/c47-31-23-46(19-16-38-31)36-39-21-28-20-29(25-6-2-1-3-7-25)32(40-33(28)42-36)26-11-9-24(10-12-26)22-45-17-13-27(14-18-45)34-41-35(44-43-34)30-8-4-5-15-37-30/h1-12,15,20-21,27,31,38,47H,13-14,16-19,22-23H2,(H,41,43,44)/t31-/m1/s1
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n/an/a 25n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243771
PNG
(2-(4-methylpiperazin-1-yl)-6-phenyl-7-(4-((4-(5-(p...)
Show SMILES CN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H38N10/c1-45-19-21-47(22-20-45)37-39-24-30-23-31(27-7-3-2-4-8-27)33(40-34(30)42-37)28-12-10-26(11-13-28)25-46-17-14-29(15-18-46)35-41-36(44-43-35)32-9-5-6-16-38-32/h2-13,16,23-24,29H,14-15,17-22,25H2,1H3,(H,41,43,44)
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n/an/a 27n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243783
PNG
(2-(4-(1-methylazetidin-3-yl)piperazin-1-yl)-6-phen...)
Show SMILES CN1CC(C1)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C40H43N11/c1-48-26-33(27-48)50-19-21-51(22-20-50)40-42-24-32-23-34(29-7-3-2-4-8-29)36(43-37(32)45-40)30-12-10-28(11-13-30)25-49-17-14-31(15-18-49)38-44-39(47-46-38)35-9-5-6-16-41-35/h2-13,16,23-24,31,33H,14-15,17-22,25-27H2,1H3,(H,44,46,47)
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n/an/a 27n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243766
PNG
(2-((2S,6R)-2,6-dimethylmorpholino)-6-phenyl-7-(4-(...)
Show SMILES C[C@H]1CN(C[C@@H](C)O1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H39N9O/c1-25-22-47(23-26(2)48-25)38-40-21-31-20-32(28-8-4-3-5-9-28)34(41-35(31)43-38)29-13-11-27(12-14-29)24-46-18-15-30(16-19-46)36-42-37(45-44-36)33-10-6-7-17-39-33/h3-14,17,20-21,25-26,30H,15-16,18-19,22-24H2,1-2H3,(H,42,44,45)/t25-,26+
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n/an/a 28n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243772
PNG
(2-((2R,5S)-2,5-dimethylpiperazin-1-yl)-6-phenyl-7-...)
Show SMILES C[C@H]1CN([C@H](C)CN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H40N10/c1-25-23-48(26(2)21-40-25)38-41-22-31-20-32(28-8-4-3-5-9-28)34(42-35(31)44-38)29-13-11-27(12-14-29)24-47-18-15-30(16-19-47)36-43-37(46-45-36)33-10-6-7-17-39-33/h3-14,17,20,22,25-26,30,40H,15-16,18-19,21,23-24H2,1-2H3,(H,43,45,46)/t25-,26+/m0/s1
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n/an/a 29n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243782
PNG
(2-(4-(6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4H-1,2,4...)
Show SMILES OCCN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H40N10O/c49-23-22-46-18-20-48(21-19-46)38-40-25-31-24-32(28-6-2-1-3-7-28)34(41-35(31)43-38)29-11-9-27(10-12-29)26-47-16-13-30(14-17-47)36-42-37(45-44-36)33-8-4-5-15-39-33/h1-12,15,24-25,30,49H,13-14,16-23,26H2,(H,42,44,45)
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n/an/a 31n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243776
PNG
(2-(1H-imidazol-1-yl)-6-phenyl-7-(4-((4-(5-(pyridin...)
Show SMILES C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)-n1ccnc1
Show InChI InChI=1S/C35H30N10/c1-2-6-25(7-3-1)29-20-28-21-38-35(45-19-16-36-23-45)41-32(28)39-31(29)26-11-9-24(10-12-26)22-44-17-13-27(14-18-44)33-40-34(43-42-33)30-8-4-5-15-37-30/h1-12,15-16,19-21,23,27H,13-14,17-18,22H2,(H,40,42,43)
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n/an/a 35n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243771
PNG
(2-(4-methylpiperazin-1-yl)-6-phenyl-7-(4-((4-(5-(p...)
Show SMILES CN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H38N10/c1-45-19-21-47(22-20-45)37-39-24-30-23-31(27-7-3-2-4-8-27)33(40-34(30)42-37)28-12-10-26(11-13-28)25-46-17-14-29(15-18-46)35-41-36(44-43-35)32-9-5-6-16-38-32/h2-13,16,23-24,29H,14-15,17-22,25H2,1H3,(H,41,43,44)
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n/an/a 36n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243763
PNG
(6-phenyl-2-(piperidin-1-yl)-7-(4-((4-(5-(pyridin-2...)
Show SMILES C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)N1CCCCC1
Show InChI InChI=1S/C37H37N9/c1-3-9-27(10-4-1)31-23-30-24-39-37(46-19-7-2-8-20-46)42-34(30)40-33(31)28-14-12-26(13-15-28)25-45-21-16-29(17-22-45)35-41-36(44-43-35)32-11-5-6-18-38-32/h1,3-6,9-15,18,23-24,29H,2,7-8,16-17,19-22,25H2,(H,41,43,44)
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n/an/a 36n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243769
PNG
(2-((R)-3-methylpiperazin-1-yl)-6-phenyl-7-(4-((4-(...)
Show SMILES C[C@@H]1CN(CCN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H38N10/c1-25-23-47(20-17-38-25)37-40-22-30-21-31(27-7-3-2-4-8-27)33(41-34(30)43-37)28-12-10-26(11-13-28)24-46-18-14-29(15-19-46)35-42-36(45-44-35)32-9-5-6-16-39-32/h2-13,16,21-22,25,29,38H,14-15,17-20,23-24H2,1H3,(H,42,44,45)/t25-/m1/s1
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n/an/a 36n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243767
PNG
(2-(1,1-Dioxo-1lambda6-thiomorpholin-4-yl)-6-phenyl...)
Show SMILES O=S1(=O)CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C36H35N9O2S/c46-48(47)20-18-45(19-21-48)36-38-23-29-22-30(26-6-2-1-3-7-26)32(39-33(29)41-36)27-11-9-25(10-12-27)24-44-16-13-28(14-17-44)34-40-35(43-42-34)31-8-4-5-15-37-31/h1-12,15,22-23,28H,13-14,16-21,24H2,(H,40,42,43)
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n/an/a 38n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243216
PNG
(CHEMBL443661 | N,N-dimethyl-2-(4-(6-phenyl-7-(4-((...)
Show SMILES CN(C)CCN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C40H45N11/c1-48(2)20-21-49-22-24-51(25-23-49)40-42-27-33-26-34(30-8-4-3-5-9-30)36(43-37(33)45-40)31-13-11-29(12-14-31)28-50-18-15-32(16-19-50)38-44-39(47-46-38)35-10-6-7-17-41-35/h3-14,17,26-27,32H,15-16,18-25,28H2,1-2H3,(H,44,46,47)
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n/an/a 39n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243779
PNG
(CHEMBL447348 | N,N-dimethyl-4-(6-phenyl-7-(4-((4-(...)
Show SMILES CN(C)C(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C39H41N11O/c1-47(2)39(51)50-22-20-49(21-23-50)38-41-25-31-24-32(28-8-4-3-5-9-28)34(42-35(31)44-38)29-13-11-27(12-14-29)26-48-18-15-30(16-19-48)36-43-37(46-45-36)33-10-6-7-17-40-33/h3-14,17,24-25,30H,15-16,18-23,26H2,1-2H3,(H,43,45,46)
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n/an/a 40n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243782
PNG
(2-(4-(6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4H-1,2,4...)
Show SMILES OCCN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H40N10O/c49-23-22-46-18-20-48(21-19-46)38-40-25-31-24-32(28-6-2-1-3-7-28)34(41-35(31)43-38)29-11-9-27(10-12-29)26-47-16-13-30(14-17-47)36-42-37(45-44-36)33-8-4-5-15-39-33/h1-12,15,24-25,30,49H,13-14,16-23,26H2,(H,42,44,45)
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n/an/a 41n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243766
PNG
(2-((2S,6R)-2,6-dimethylmorpholino)-6-phenyl-7-(4-(...)
Show SMILES C[C@H]1CN(C[C@@H](C)O1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H39N9O/c1-25-22-47(23-26(2)48-25)38-40-21-31-20-32(28-8-4-3-5-9-28)34(41-35(31)43-38)29-13-11-27(12-14-29)24-46-18-15-30(16-19-46)36-42-37(45-44-36)33-10-6-7-17-39-33/h3-14,17,20-21,25-26,30H,15-16,18-19,22-24H2,1-2H3,(H,42,44,45)/t25-,26+
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n/an/a 42n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243772
PNG
(2-((2R,5S)-2,5-dimethylpiperazin-1-yl)-6-phenyl-7-...)
Show SMILES C[C@H]1CN([C@H](C)CN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H40N10/c1-25-23-48(26(2)21-40-25)38-41-22-31-20-32(28-8-4-3-5-9-28)34(42-35(31)44-38)29-13-11-27(12-14-29)24-47-18-15-30(16-19-47)36-43-37(46-45-36)33-10-6-7-17-39-33/h3-14,17,20,22,25-26,30,40H,15-16,18-19,21,23-24H2,1-2H3,(H,43,45,46)/t25-,26+/m0/s1
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n/an/a 43n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243764
PNG
(2-morpholino-6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4...)
Show SMILES C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)N1CCOCC1
Show InChI InChI=1S/C36H35N9O/c1-2-6-26(7-3-1)30-22-29-23-38-36(45-18-20-46-21-19-45)41-33(29)39-32(30)27-11-9-25(10-12-27)24-44-16-13-28(14-17-44)34-40-35(43-42-34)31-8-4-5-15-37-31/h1-12,15,22-23,28H,13-14,16-21,24H2,(H,40,42,43)
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n/an/a 43n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243769
PNG
(2-((R)-3-methylpiperazin-1-yl)-6-phenyl-7-(4-((4-(...)
Show SMILES C[C@@H]1CN(CCN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H38N10/c1-25-23-47(20-17-38-25)37-40-22-30-21-31(27-7-3-2-4-8-27)33(41-34(30)43-37)28-12-10-26(11-13-28)24-46-18-14-29(15-19-46)35-42-36(45-44-35)32-9-5-6-16-39-32/h2-13,16,21-22,25,29,38H,14-15,17-20,23-24H2,1H3,(H,42,44,45)/t25-/m1/s1
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n/an/a 44n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243765
PNG
(1-(6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4H-1,2,4-tr...)
Show SMILES OC1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H37N9O/c47-30-15-20-46(21-16-30)37-39-23-29-22-31(26-6-2-1-3-7-26)33(40-34(29)42-37)27-11-9-25(10-12-27)24-45-18-13-28(14-19-45)35-41-36(44-43-35)32-8-4-5-17-38-32/h1-12,17,22-23,28,30,47H,13-16,18-21,24H2,(H,41,43,44)
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n/an/a 45n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243768
PNG
(2-((3S,5R)-3,5-dimethylpiperazin-1-yl)-6-phenyl-7-...)
Show SMILES C[C@H]1CN(C[C@@H](C)N1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H40N10/c1-25-22-48(23-26(2)41-25)38-40-21-31-20-32(28-8-4-3-5-9-28)34(42-35(31)44-38)29-13-11-27(12-14-29)24-47-18-15-30(16-19-47)36-43-37(46-45-36)33-10-6-7-17-39-33/h3-14,17,20-21,25-26,30,41H,15-16,18-19,22-24H2,1-2H3,(H,43,45,46)/t25-,26+
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n/an/a 45n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243768
PNG
(2-((3S,5R)-3,5-dimethylpiperazin-1-yl)-6-phenyl-7-...)
Show SMILES C[C@H]1CN(C[C@@H](C)N1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H40N10/c1-25-22-48(23-26(2)41-25)38-40-21-31-20-32(28-8-4-3-5-9-28)34(42-35(31)44-38)29-13-11-27(12-14-29)24-47-18-15-30(16-19-47)36-43-37(46-45-36)33-10-6-7-17-39-33/h3-14,17,20-21,25-26,30,41H,15-16,18-19,22-24H2,1-2H3,(H,43,45,46)/t25-,26+
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n/an/a 46n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243770
PNG
(2-((S)-3-methylpiperazin-1-yl)-6-phenyl-7-(4-((4-(...)
Show SMILES C[C@H]1CN(CCN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H38N10/c1-25-23-47(20-17-38-25)37-40-22-30-21-31(27-7-3-2-4-8-27)33(41-34(30)43-37)28-12-10-26(11-13-28)24-46-18-14-29(15-19-46)35-42-36(45-44-35)32-9-5-6-16-39-32/h2-13,16,21-22,25,29,38H,14-15,17-20,23-24H2,1H3,(H,42,44,45)/t25-/m0/s1
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n/an/a 47n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243771
PNG
(2-(4-methylpiperazin-1-yl)-6-phenyl-7-(4-((4-(5-(p...)
Show SMILES CN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H38N10/c1-45-19-21-47(22-20-45)37-39-24-30-23-31(27-7-3-2-4-8-27)33(40-34(30)42-37)28-12-10-26(11-13-28)25-46-17-14-29(15-18-46)35-41-36(44-43-35)32-9-5-6-16-38-32/h2-13,16,23-24,29H,14-15,17-22,25H2,1H3,(H,41,43,44)
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n/an/a 52n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243786
PNG
(6-(4-methylpiperazin-1-yl)-3-phenyl-2-(4-((4-(5-(p...)
Show SMILES CN1CCN(CC1)c1cc2cc(-c3ccccc3)c(nc2cn1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H39N9/c1-45-19-21-47(22-20-45)35-24-31-23-32(28-7-3-2-4-8-28)36(41-34(31)25-40-35)29-12-10-27(11-13-29)26-46-17-14-30(15-18-46)37-42-38(44-43-37)33-9-5-6-16-39-33/h2-13,16,23-25,30H,14-15,17-22,26H2,1H3,(H,42,43,44)
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n/an/a 59n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243774
PNG
((2R)-4-(6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4H-1,2...)
Show SMILES O[C@@H]1CN(CCN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C36H36N10O/c47-31-23-46(19-16-38-31)36-39-21-28-20-29(25-6-2-1-3-7-25)32(40-33(28)42-36)26-11-9-24(10-12-26)22-45-17-13-27(14-18-45)34-41-35(44-43-34)30-8-4-5-15-37-30/h1-12,15,20-21,27,31,38,47H,13-14,16-19,22-23H2,(H,41,43,44)/t31-/m1/s1
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n/an/a 61n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243774
PNG
((2R)-4-(6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4H-1,2...)
Show SMILES O[C@@H]1CN(CCN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C36H36N10O/c47-31-23-46(19-16-38-31)36-39-21-28-20-29(25-6-2-1-3-7-25)32(40-33(28)42-36)26-11-9-24(10-12-26)22-45-17-13-27(14-18-45)34-41-35(44-43-34)30-8-4-5-15-37-30/h1-12,15,20-21,27,31,38,47H,13-14,16-19,22-23H2,(H,41,43,44)/t31-/m1/s1
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n/an/a 67n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243775
PNG
(CHEMBL454859 | N,N-dimethyl-1-(6-phenyl-7-(4-((4-(...)
Show SMILES CN(C)C1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C39H42N10/c1-47(2)32-17-22-49(23-18-32)39-41-25-31-24-33(28-8-4-3-5-9-28)35(42-36(31)44-39)29-13-11-27(12-14-29)26-48-20-15-30(16-21-48)37-43-38(46-45-37)34-10-6-7-19-40-34/h3-14,19,24-25,30,32H,15-18,20-23,26H2,1-2H3,(H,43,45,46)
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n/an/a 70n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243776
PNG
(2-(1H-imidazol-1-yl)-6-phenyl-7-(4-((4-(5-(pyridin...)
Show SMILES C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)-n1ccnc1
Show InChI InChI=1S/C35H30N10/c1-2-6-25(7-3-1)29-20-28-21-38-35(45-19-16-36-23-45)41-32(28)39-31(29)26-11-9-24(10-12-26)22-44-17-13-27(14-18-44)33-40-34(43-42-33)30-8-4-5-15-37-30/h1-12,15-16,19-21,23,27H,13-14,17-18,22H2,(H,40,42,43)
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n/an/a 73n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243770
PNG
(2-((S)-3-methylpiperazin-1-yl)-6-phenyl-7-(4-((4-(...)
Show SMILES C[C@H]1CN(CCN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H38N10/c1-25-23-47(20-17-38-25)37-40-22-30-21-31(27-7-3-2-4-8-27)33(41-34(30)43-37)28-12-10-26(11-13-28)24-46-18-14-29(15-19-46)35-42-36(45-44-35)32-9-5-6-16-39-32/h2-13,16,21-22,25,29,38H,14-15,17-20,23-24H2,1H3,(H,42,44,45)/t25-/m0/s1
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n/an/a 75n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243762
PNG
(2-(3,3-difluoropyrrolidin-1-yl)-6-phenyl-7-(4-((4-...)
Show SMILES FC1(F)CCN(C1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C36H33F2N9/c37-36(38)15-19-47(23-36)35-40-21-28-20-29(25-6-2-1-3-7-25)31(41-32(28)43-35)26-11-9-24(10-12-26)22-46-17-13-27(14-18-46)33-42-34(45-44-33)30-8-4-5-16-39-30/h1-12,16,20-21,27H,13-15,17-19,22-23H2,(H,42,44,45)
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n/an/a 75n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243768
PNG
(2-((3S,5R)-3,5-dimethylpiperazin-1-yl)-6-phenyl-7-...)
Show SMILES C[C@H]1CN(C[C@@H](C)N1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H40N10/c1-25-22-48(23-26(2)41-25)38-40-21-31-20-32(28-8-4-3-5-9-28)34(42-35(31)44-38)29-13-11-27(12-14-29)24-47-18-15-30(16-19-47)36-43-37(46-45-36)33-10-6-7-17-39-33/h3-14,17,20-21,25-26,30,41H,15-16,18-19,22-24H2,1-2H3,(H,43,45,46)/t25-,26+
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n/an/a 77n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM24867
PNG
(1-(2-aminophenyl)-3-[({4-[2-(methylsulfanyl)-6-phe...)
Show SMILES CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CNCCC(=O)c2ccccc2N)cc1
Show InChI InChI=1S/C30H27N5OS/c1-37-30-33-19-23-17-25(21-7-3-2-4-8-21)28(34-29(23)35-30)22-13-11-20(12-14-22)18-32-16-15-27(36)24-9-5-6-10-26(24)31/h2-14,17,19,32H,15-16,18,31H2,1H3
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n/an/a 78n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243773
PNG
(CHEMBL505758 | N-(2-(dimethylamino)ethyl)-6-phenyl...)
Show SMILES CN(C)CCNc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C36H38N10/c1-45(2)21-18-38-36-39-23-29-22-30(26-8-4-3-5-9-26)32(40-33(29)42-36)27-13-11-25(12-14-27)24-46-19-15-28(16-20-46)34-41-35(44-43-34)31-10-6-7-17-37-31/h3-14,17,22-23,28H,15-16,18-21,24H2,1-2H3,(H,41,43,44)(H,38,39,40,42)
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n/an/a 79n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM24867
PNG
(1-(2-aminophenyl)-3-[({4-[2-(methylsulfanyl)-6-phe...)
Show SMILES CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CNCCC(=O)c2ccccc2N)cc1
Show InChI InChI=1S/C30H27N5OS/c1-37-30-33-19-23-17-25(21-7-3-2-4-8-21)28(34-29(23)35-30)22-13-11-20(12-14-22)18-32-16-15-27(36)24-9-5-6-10-26(24)31/h2-14,17,19,32H,15-16,18,31H2,1H3
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n/an/a 90n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243763
PNG
(6-phenyl-2-(piperidin-1-yl)-7-(4-((4-(5-(pyridin-2...)
Show SMILES C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)N1CCCCC1
Show InChI InChI=1S/C37H37N9/c1-3-9-27(10-4-1)31-23-30-24-39-37(46-19-7-2-8-20-46)42-34(30)40-33(31)28-14-12-26(13-15-28)25-45-21-16-29(17-22-45)35-41-36(44-43-35)32-11-5-6-18-38-32/h1,3-6,9-15,18,23-24,29H,2,7-8,16-17,19-22,25H2,(H,41,43,44)
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n/an/a 93n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM24880
PNG
(CHEMBL252857 | N-methyl-6-phenyl-7-[4-({4-[5-(pyri...)
Show SMILES CNc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C33H31N9/c1-34-33-36-20-26-19-27(23-7-3-2-4-8-23)29(37-30(26)39-33)24-12-10-22(11-13-24)21-42-17-14-25(15-18-42)31-38-32(41-40-31)28-9-5-6-16-35-28/h2-13,16,19-20,25H,14-15,17-18,21H2,1H3,(H,38,40,41)(H,34,36,37,39)
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n/an/a 94n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243768
PNG
(2-((3S,5R)-3,5-dimethylpiperazin-1-yl)-6-phenyl-7-...)
Show SMILES C[C@H]1CN(C[C@@H](C)N1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H40N10/c1-25-22-48(23-26(2)41-25)38-40-21-31-20-32(28-8-4-3-5-9-28)34(42-35(31)44-38)29-13-11-27(12-14-29)24-47-18-15-30(16-19-47)36-43-37(46-45-36)33-10-6-7-17-39-33/h3-14,17,20-21,25-26,30,41H,15-16,18-19,22-24H2,1-2H3,(H,43,45,46)/t25-,26+
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n/an/a 101n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243766
PNG
(2-((2S,6R)-2,6-dimethylmorpholino)-6-phenyl-7-(4-(...)
Show SMILES C[C@H]1CN(C[C@@H](C)O1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H39N9O/c1-25-22-47(23-26(2)48-25)38-40-21-31-20-32(28-8-4-3-5-9-28)34(41-35(31)43-38)29-13-11-27(12-14-29)24-46-18-15-30(16-19-46)36-42-37(45-44-36)33-10-6-7-17-39-33/h3-14,17,20-21,25-26,30H,15-16,18-19,22-24H2,1-2H3,(H,42,44,45)/t25-,26+
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n/an/a 102n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243770
PNG
(2-((S)-3-methylpiperazin-1-yl)-6-phenyl-7-(4-((4-(...)
Show SMILES C[C@H]1CN(CCN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H38N10/c1-25-23-47(20-17-38-25)37-40-22-30-21-31(27-7-3-2-4-8-27)33(41-34(30)43-37)28-12-10-26(11-13-28)24-46-18-14-29(15-19-46)35-42-36(45-44-35)32-9-5-6-16-39-32/h2-13,16,21-22,25,29,38H,14-15,17-20,23-24H2,1H3,(H,42,44,45)/t25-/m0/s1
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n/an/a 125n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243781
PNG
(2-(5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazin-7(8H)...)
Show SMILES C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)N1CCn2cnnc2C1
Show InChI InChI=1S/C37H34N12/c1-2-6-26(7-3-1)30-20-29-21-39-37(48-18-19-49-24-40-44-32(49)23-48)43-34(29)41-33(30)27-11-9-25(10-12-27)22-47-16-13-28(14-17-47)35-42-36(46-45-35)31-8-4-5-15-38-31/h1-12,15,20-21,24,28H,13-14,16-19,22-23H2,(H,42,45,46)
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n/an/a 125n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243786
PNG
(6-(4-methylpiperazin-1-yl)-3-phenyl-2-(4-((4-(5-(p...)
Show SMILES CN1CCN(CC1)c1cc2cc(-c3ccccc3)c(nc2cn1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H39N9/c1-45-19-21-47(22-20-45)35-24-31-23-32(28-7-3-2-4-8-28)36(41-34(31)25-40-35)29-12-10-27(11-13-29)26-46-17-14-30(15-18-46)37-42-38(44-43-37)33-9-5-6-16-39-33/h2-13,16,23-25,30H,14-15,17-22,26H2,1H3,(H,42,43,44)
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n/an/a 133n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243781
PNG
(2-(5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazin-7(8H)...)
Show SMILES C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)N1CCn2cnnc2C1
Show InChI InChI=1S/C37H34N12/c1-2-6-26(7-3-1)30-20-29-21-39-37(48-18-19-49-24-40-44-32(49)23-48)43-34(29)41-33(30)27-11-9-25(10-12-27)22-47-16-13-28(14-17-47)35-42-36(46-45-35)31-8-4-5-15-38-31/h1-12,15,20-21,24,28H,13-14,16-19,22-23H2,(H,42,45,46)
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n/an/a 138n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243777
PNG
(1-(4-(6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4H-1,2,4...)
Show SMILES CC(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H38N10O/c1-26(49)47-19-21-48(22-20-47)38-40-24-31-23-32(28-7-3-2-4-8-28)34(41-35(31)43-38)29-12-10-27(11-13-29)25-46-17-14-30(15-18-46)36-42-37(45-44-36)33-9-5-6-16-39-33/h2-13,16,23-24,30H,14-15,17-22,25H2,1H3,(H,42,44,45)
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n/an/a 145n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243773
PNG
(CHEMBL505758 | N-(2-(dimethylamino)ethyl)-6-phenyl...)
Show SMILES CN(C)CCNc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C36H38N10/c1-45(2)21-18-38-36-39-23-29-22-30(26-8-4-3-5-9-26)32(40-33(29)42-36)27-13-11-25(12-14-27)24-46-19-15-28(16-20-46)34-41-35(44-43-34)31-10-6-7-17-37-31/h3-14,17,22-23,28H,15-16,18-21,24H2,1-2H3,(H,41,43,44)(H,38,39,40,42)
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n/an/a 154n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243765
PNG
(1-(6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4H-1,2,4-tr...)
Show SMILES OC1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H37N9O/c47-30-15-20-46(21-16-30)37-39-23-29-22-31(26-6-2-1-3-7-26)33(40-34(29)42-37)27-11-9-25(10-12-27)24-45-18-13-28(14-19-45)35-41-36(44-43-35)32-8-4-5-17-38-32/h1-12,17,22-23,28,30,47H,13-16,18-21,24H2,(H,41,43,44)
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n/an/a 168n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243779
PNG
(CHEMBL447348 | N,N-dimethyl-4-(6-phenyl-7-(4-((4-(...)
Show SMILES CN(C)C(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C39H41N11O/c1-47(2)39(51)50-22-20-49(21-23-50)38-41-25-31-24-32(28-8-4-3-5-9-28)34(42-35(31)44-38)29-13-11-27(12-14-29)26-48-18-15-30(16-19-48)36-43-37(46-45-36)33-10-6-7-17-40-33/h3-14,17,24-25,30H,15-16,18-23,26H2,1-2H3,(H,43,45,46)
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n/an/a 177n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243766
PNG
(2-((2S,6R)-2,6-dimethylmorpholino)-6-phenyl-7-(4-(...)
Show SMILES C[C@H]1CN(C[C@@H](C)O1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H39N9O/c1-25-22-47(23-26(2)48-25)38-40-21-31-20-32(28-8-4-3-5-9-28)34(41-35(31)43-38)29-13-11-27(12-14-29)24-46-18-15-30(16-19-46)36-42-37(45-44-36)33-10-6-7-17-39-33/h3-14,17,20-21,25-26,30H,15-16,18-19,22-24H2,1-2H3,(H,42,44,45)/t25-,26+
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n/an/a 184n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243772
PNG
(2-((2R,5S)-2,5-dimethylpiperazin-1-yl)-6-phenyl-7-...)
Show SMILES C[C@H]1CN([C@H](C)CN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H40N10/c1-25-23-48(26(2)21-40-25)38-41-22-31-20-32(28-8-4-3-5-9-28)34(42-35(31)44-38)29-13-11-27(12-14-29)24-47-18-15-30(16-19-47)36-43-37(46-45-36)33-10-6-7-17-39-33/h3-14,17,20,22,25-26,30,40H,15-16,18-19,21,23-24H2,1-2H3,(H,43,45,46)/t25-,26+/m0/s1
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n/an/a 194n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243778
PNG
(2-(4-(methylsulfonyl)piperazin-1-yl)-6-phenyl-7-(4...)
Show SMILES CS(=O)(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C37H38N10O2S/c1-50(48,49)47-21-19-46(20-22-47)37-39-24-30-23-31(27-7-3-2-4-8-27)33(40-34(30)42-37)28-12-10-26(11-13-28)25-45-17-14-29(15-18-45)35-41-36(44-43-35)32-9-5-6-16-38-32/h2-13,16,23-24,29H,14-15,17-22,25H2,1H3,(H,41,43,44)
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n/an/a 196n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243772
PNG
(2-((2R,5S)-2,5-dimethylpiperazin-1-yl)-6-phenyl-7-...)
Show SMILES C[C@H]1CN([C@H](C)CN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H40N10/c1-25-23-48(26(2)21-40-25)38-41-22-31-20-32(28-8-4-3-5-9-28)34(42-35(31)44-38)29-13-11-27(12-14-29)24-47-18-15-30(16-19-47)36-43-37(46-45-36)33-10-6-7-17-39-33/h3-14,17,20,22,25-26,30,40H,15-16,18-19,21,23-24H2,1-2H3,(H,43,45,46)/t25-,26+/m0/s1
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n/an/a 199n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243773
PNG
(CHEMBL505758 | N-(2-(dimethylamino)ethyl)-6-phenyl...)
Show SMILES CN(C)CCNc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C36H38N10/c1-45(2)21-18-38-36-39-23-29-22-30(26-8-4-3-5-9-26)32(40-33(29)42-36)27-13-11-25(12-14-27)24-46-19-15-28(16-20-46)34-41-35(44-43-34)31-10-6-7-17-37-31/h3-14,17,22-23,28H,15-16,18-21,24H2,1-2H3,(H,41,43,44)(H,38,39,40,42)
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n/an/a 208n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243773
PNG
(CHEMBL505758 | N-(2-(dimethylamino)ethyl)-6-phenyl...)
Show SMILES CN(C)CCNc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C36H38N10/c1-45(2)21-18-38-36-39-23-29-22-30(26-8-4-3-5-9-26)32(40-33(29)42-36)27-13-11-25(12-14-27)24-46-19-15-28(16-20-46)34-41-35(44-43-34)31-10-6-7-17-37-31/h3-14,17,22-23,28H,15-16,18-21,24H2,1-2H3,(H,41,43,44)(H,38,39,40,42)
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n/an/a 223n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243763
PNG
(6-phenyl-2-(piperidin-1-yl)-7-(4-((4-(5-(pyridin-2...)
Show SMILES C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)N1CCCCC1
Show InChI InChI=1S/C37H37N9/c1-3-9-27(10-4-1)31-23-30-24-39-37(46-19-7-2-8-20-46)42-34(30)40-33(31)28-14-12-26(13-15-28)25-45-21-16-29(17-22-45)35-41-36(44-43-35)32-11-5-6-18-38-32/h1,3-6,9-15,18,23-24,29H,2,7-8,16-17,19-22,25H2,(H,41,43,44)
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n/an/a 229n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243764
PNG
(2-morpholino-6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4...)
Show SMILES C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)N1CCOCC1
Show InChI InChI=1S/C36H35N9O/c1-2-6-26(7-3-1)30-22-29-23-38-36(45-18-20-46-21-19-45)41-33(29)39-32(30)27-11-9-25(10-12-27)24-44-16-13-28(14-17-44)34-40-35(43-42-34)31-8-4-5-15-37-31/h1-12,15,22-23,28H,13-14,16-21,24H2,(H,40,42,43)
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n/an/a 243n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243762
PNG
(2-(3,3-difluoropyrrolidin-1-yl)-6-phenyl-7-(4-((4-...)
Show SMILES FC1(F)CCN(C1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C36H33F2N9/c37-36(38)15-19-47(23-36)35-40-21-28-20-29(25-6-2-1-3-7-25)31(41-32(28)43-35)26-11-9-24(10-12-26)22-46-17-13-27(14-18-46)33-42-34(45-44-33)30-8-4-5-16-39-30/h1-12,16,20-21,27H,13-15,17-19,22-23H2,(H,42,44,45)
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n/an/a 252n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243784
PNG
(5-(4-methylpiperazin-1-yl)-3-phenyl-2-(4-((4-(5-(p...)
Show SMILES CN1CCN(CC1)c1nccc2nc(-c3ccc(CN4CCC(CC4)c4nnc([nH]4)-c4ccccn4)cc3)c(cc12)-c1ccccc1
Show InChI InChI=1S/C38H39N9/c1-45-21-23-47(24-22-45)38-32-25-31(28-7-3-2-4-8-28)35(41-33(32)14-18-40-38)29-12-10-27(11-13-29)26-46-19-15-30(16-20-46)36-42-37(44-43-36)34-9-5-6-17-39-34/h2-14,17-18,25,30H,15-16,19-24,26H2,1H3,(H,42,43,44)
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n/an/a 285n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243767
PNG
(2-(1,1-Dioxo-1lambda6-thiomorpholin-4-yl)-6-phenyl...)
Show SMILES O=S1(=O)CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C36H35N9O2S/c46-48(47)20-18-45(19-21-48)36-38-23-29-22-30(26-6-2-1-3-7-26)32(39-33(29)41-36)27-11-9-25(10-12-27)24-44-16-13-28(14-17-44)34-40-35(43-42-34)31-8-4-5-15-37-31/h1-12,15,22-23,28H,13-14,16-21,24H2,(H,40,42,43)
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n/an/a 297n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM24867
PNG
(1-(2-aminophenyl)-3-[({4-[2-(methylsulfanyl)-6-phe...)
Show SMILES CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CNCCC(=O)c2ccccc2N)cc1
Show InChI InChI=1S/C30H27N5OS/c1-37-30-33-19-23-17-25(21-7-3-2-4-8-21)28(34-29(23)35-30)22-13-11-20(12-14-22)18-32-16-15-27(36)24-9-5-6-10-26(24)31/h2-14,17,19,32H,15-16,18,31H2,1H3
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n/an/a 388n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243774
PNG
((2R)-4-(6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4H-1,2...)
Show SMILES O[C@@H]1CN(CCN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C36H36N10O/c47-31-23-46(19-16-38-31)36-39-21-28-20-29(25-6-2-1-3-7-25)32(40-33(28)42-36)26-11-9-24(10-12-26)22-45-17-13-27(14-18-45)34-41-35(44-43-34)30-8-4-5-15-37-30/h1-12,15,20-21,27,31,38,47H,13-14,16-19,22-23H2,(H,41,43,44)/t31-/m1/s1
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n/an/a 421n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243762
PNG
(2-(3,3-difluoropyrrolidin-1-yl)-6-phenyl-7-(4-((4-...)
Show SMILES FC1(F)CCN(C1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C36H33F2N9/c37-36(38)15-19-47(23-36)35-40-21-28-20-29(25-6-2-1-3-7-25)31(41-32(28)43-35)26-11-9-24(10-12-26)22-46-17-13-27(14-18-46)33-42-34(45-44-33)30-8-4-5-16-39-30/h1-12,16,20-21,27H,13-15,17-19,22-23H2,(H,42,44,45)
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n/an/a 462n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243784
PNG
(5-(4-methylpiperazin-1-yl)-3-phenyl-2-(4-((4-(5-(p...)
Show SMILES CN1CCN(CC1)c1nccc2nc(-c3ccc(CN4CCC(CC4)c4nnc([nH]4)-c4ccccn4)cc3)c(cc12)-c1ccccc1
Show InChI InChI=1S/C38H39N9/c1-45-21-23-47(24-22-45)38-32-25-31(28-7-3-2-4-8-28)35(41-33(32)14-18-40-38)29-12-10-27(11-13-29)26-46-19-15-30(16-20-46)36-42-37(44-43-36)34-9-5-6-17-39-34/h2-14,17-18,25,30H,15-16,19-24,26H2,1H3,(H,42,43,44)
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n/an/a 539n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243776
PNG
(2-(1H-imidazol-1-yl)-6-phenyl-7-(4-((4-(5-(pyridin...)
Show SMILES C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)-n1ccnc1
Show InChI InChI=1S/C35H30N10/c1-2-6-25(7-3-1)29-20-28-21-38-35(45-19-16-36-23-45)41-32(28)39-31(29)26-11-9-24(10-12-26)22-44-17-13-27(14-18-44)33-40-34(43-42-33)30-8-4-5-15-37-30/h1-12,15-16,19-21,23,27H,13-14,17-18,22H2,(H,40,42,43)
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n/an/a 684n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243785
PNG
(8-(4-methylpiperazin-1-yl)-3-phenyl-2-(4-((4-(5-(p...)
Show SMILES CN1CCN(CC1)c1nccc2cc(-c3ccccc3)c(nc12)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H39N9/c1-45-21-23-47(24-22-45)38-35-31(14-18-40-38)25-32(28-7-3-2-4-8-28)34(41-35)29-12-10-27(11-13-29)26-46-19-15-30(16-20-46)36-42-37(44-43-36)33-9-5-6-17-39-33/h2-14,17-18,25,30H,15-16,19-24,26H2,1H3,(H,42,43,44)
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n/an/a 720n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243781
PNG
(2-(5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazin-7(8H)...)
Show SMILES C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)N1CCn2cnnc2C1
Show InChI InChI=1S/C37H34N12/c1-2-6-26(7-3-1)30-20-29-21-39-37(48-18-19-49-24-40-44-32(49)23-48)43-34(29)41-33(30)27-11-9-25(10-12-27)22-47-16-13-28(14-17-47)35-42-36(46-45-35)31-8-4-5-15-38-31/h1-12,15,20-21,24,28H,13-14,16-19,22-23H2,(H,42,45,46)
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n/an/a 735n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243786
PNG
(6-(4-methylpiperazin-1-yl)-3-phenyl-2-(4-((4-(5-(p...)
Show SMILES CN1CCN(CC1)c1cc2cc(-c3ccccc3)c(nc2cn1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H39N9/c1-45-19-21-47(22-20-45)35-24-31-23-32(28-7-3-2-4-8-28)36(41-34(31)25-40-35)29-12-10-27(11-13-29)26-46-17-14-30(15-18-46)37-42-38(44-43-37)33-9-5-6-16-39-33/h2-13,16,23-25,30H,14-15,17-22,26H2,1H3,(H,42,43,44)
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n/an/a 740n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM24880
PNG
(CHEMBL252857 | N-methyl-6-phenyl-7-[4-({4-[5-(pyri...)
Show SMILES CNc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C33H31N9/c1-34-33-36-20-26-19-27(23-7-3-2-4-8-23)29(37-30(26)39-33)24-12-10-22(11-13-24)21-42-17-14-25(15-18-42)31-38-32(41-40-31)28-9-5-6-16-35-28/h2-13,16,19-20,25H,14-15,17-18,21H2,1H3,(H,38,40,41)(H,34,36,37,39)
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n/an/a 899n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50243786
PNG
(6-(4-methylpiperazin-1-yl)-3-phenyl-2-(4-((4-(5-(p...)
Show SMILES CN1CCN(CC1)c1cc2cc(-c3ccccc3)c(nc2cn1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H39N9/c1-45-19-21-47(22-20-45)35-24-31-23-32(28-7-3-2-4-8-28)36(41-34(31)25-40-35)29-12-10-27(11-13-29)26-46-17-14-30(15-18-46)37-42-38(44-43-37)33-9-5-6-16-39-33/h2-13,16,23-25,30H,14-15,17-22,26H2,1H3,(H,42,43,44)
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n/an/a 924n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT


(Homo sapiens (human))
BDBM50243785
PNG
(8-(4-methylpiperazin-1-yl)-3-phenyl-2-(4-((4-(5-(p...)
Show SMILES CN1CCN(CC1)c1nccc2cc(-c3ccccc3)c(nc12)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Show InChI InChI=1S/C38H39N9/c1-45-21-23-47(24-22-45)38-35-31(14-18-40-38)25-32(28-7-3-2-4-8-28)34(41-35)29-12-10-27(11-13-29)26-46-19-15-30(16-20-46)36-42-37(44-43-36)33-9-5-6-17-39-33/h2-14,17-18,25,30H,15-16,19-24,26H2,1H3,(H,42,43,44)
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n/an/a 3.57E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%