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19 similar compounds to monomer 50298436

Compile data set for download or QSAR
Wt: 398.4
BDBM16922
Wt: 398.4
BDBM16923
Wt: 412.4
BDBM16925
Wt: 426.5
BDBM16933
Wt: 412.4
BDBM16934
Wt: 426.5
BDBM16935
Wt: 488.5
BDBM16936
Wt: 438.5
BDBM50298434
Wt: 474.5
BDBM50298435
Wt: 475.5
BDBM50298437
Wt: 463.5
BDBM50298438
Wt: 477.5
BDBM50298439
Wt: 513.5
BDBM50298440
Wt: 464.5
BDBM50298441
Wt: 519.6
BDBM50298442
Displayed 1 to 15 (of 19 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 19 hits for monomerid = 16922,16923,16925,16933,16934,16935,16936,50298434,50298435,50298437,50298438,50298439,50298440,50298441,50298442   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Protein kinase B (Akt 1)


(Homo sapiens (Human))
BDBM16922
PNG
(6-{5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridi...)
Show SMILES N[C@H](COc1cncc(c1)-c1ccc2CC(=O)Nc2c1)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C24H22N4O2/c25-19(7-18-12-27-22-4-2-1-3-21(18)22)14-30-20-8-17(11-26-13-20)15-5-6-16-10-24(29)28-23(16)9-15/h1-6,8-9,11-13,19,27H,7,10,14,25H2,(H,28,29)/t19-/m0/s1
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n/an/a 4.40E+3n/an/an/an/a7.522



Abbott Laboratories



Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat...


Bioorg Med Chem Lett 16: 3424-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.005
BindingDB Entry DOI: 10.7270/Q2K072JJ
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase AKT1


(Homo sapiens (Human))
BDBM16925
PNG
(5-{5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridi...)
Show SMILES N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(=O)c2c1)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C24H20N4O3/c25-17(7-16-11-27-21-4-2-1-3-19(16)21)13-31-18-8-15(10-26-12-18)14-5-6-22-20(9-14)23(29)24(30)28-22/h1-6,8-12,17,27H,7,13,25H2,(H,28,29,30)/t17-/m0/s1
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n/an/a 5.40n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of Akt


Eur J Med Chem 44: 4090-7 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.050
BindingDB Entry DOI: 10.7270/Q2GT5N74
More data for this
Ligand-Target Pair
Protein kinase B (Akt 1)


(Homo sapiens (Human))
BDBM16925
PNG
(5-{5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridi...)
Show SMILES N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(=O)c2c1)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C24H20N4O3/c25-17(7-16-11-27-21-4-2-1-3-19(16)21)13-31-18-8-15(10-26-12-18)14-5-6-22-20(9-14)23(29)24(30)28-22/h1-6,8-12,17,27H,7,13,25H2,(H,28,29,30)/t17-/m0/s1
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n/an/a 179n/an/an/an/a7.522



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Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat...


Bioorg Med Chem Lett 16: 3424-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.005
BindingDB Entry DOI: 10.7270/Q2K072JJ
More data for this
Ligand-Target Pair
Protein kinase B (Akt 1)


(Homo sapiens (Human))
BDBM16933
PNG
(5-{5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridi...)
Show SMILES CC1(C)C(=O)Nc2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1
Show InChI InChI=1S/C26H26N4O2/c1-26(2)22-11-16(7-8-24(22)30-25(26)31)17-10-20(14-28-12-17)32-15-19(27)9-18-13-29-23-6-4-3-5-21(18)23/h3-8,10-14,19,29H,9,15,27H2,1-2H3,(H,30,31)/t19-/m0/s1
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n/an/a 24.6n/an/an/an/a7.522



Abbott Laboratories



Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat...


Bioorg Med Chem Lett 16: 3424-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.005
BindingDB Entry DOI: 10.7270/Q2K072JJ
More data for this
Ligand-Target Pair
Protein kinase B (Akt 1)


(Homo sapiens (Human))
BDBM16934
PNG
(5-{5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridi...)
Show SMILES CC1C(=O)Nc2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1
Show InChI InChI=1S/C25H24N4O2/c1-15-22-10-16(6-7-24(22)29-25(15)30)17-9-20(13-27-11-17)31-14-19(26)8-18-12-28-23-5-3-2-4-21(18)23/h2-7,9-13,15,19,28H,8,14,26H2,1H3,(H,29,30)/t15?,19-/m0/s1
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n/an/a 4n/an/an/an/a7.522



Abbott Laboratories



Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat...


Bioorg Med Chem Lett 16: 3424-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.005
BindingDB Entry DOI: 10.7270/Q2K072JJ
More data for this
Ligand-Target Pair
Protein kinase B (Akt 1)


(Homo sapiens (Human))
BDBM16935
PNG
(5-{5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridi...)
Show SMILES CCC1C(=O)Nc2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1
Show InChI InChI=1S/C26H26N4O2/c1-2-21-23-11-16(7-8-25(23)30-26(21)31)17-10-20(14-28-12-17)32-15-19(27)9-18-13-29-24-6-4-3-5-22(18)24/h3-8,10-14,19,21,29H,2,9,15,27H2,1H3,(H,30,31)/t19-,21?/m0/s1
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n/an/a 80n/an/an/an/a7.522



Abbott Laboratories



Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat...


Bioorg Med Chem Lett 16: 3424-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.005
BindingDB Entry DOI: 10.7270/Q2K072JJ
More data for this
Ligand-Target Pair
Protein kinase B (Akt 1)


(Homo sapiens (Human))
BDBM16936
PNG
(5-{5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridi...)
Show SMILES N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(Cc3ccccc3)c2c1)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C31H28N4O2/c32-24(13-23-17-34-29-9-5-4-8-26(23)29)19-37-25-14-22(16-33-18-25)21-10-11-30-27(15-21)28(31(36)35-30)12-20-6-2-1-3-7-20/h1-11,14-18,24,28,34H,12-13,19,32H2,(H,35,36)/t24-,28?/m0/s1
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n/an/a 1.02E+3n/an/an/an/a7.522



Abbott Laboratories



Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat...


Bioorg Med Chem Lett 16: 3424-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.005
BindingDB Entry DOI: 10.7270/Q2K072JJ
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase AKT1


(Homo sapiens (Human))
BDBM16934
PNG
(5-{5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridi...)
Show SMILES CC1C(=O)Nc2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1
Show InChI InChI=1S/C25H24N4O2/c1-15-22-10-16(6-7-24(22)29-25(15)30)17-9-20(13-27-11-17)31-14-19(26)8-18-12-28-23-5-3-2-4-21(18)23/h2-7,9-13,15,19,28H,8,14,26H2,1H3,(H,29,30)/t15?,19-/m0/s1
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n/an/a 4n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of Akt


Eur J Med Chem 44: 4090-7 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.050
BindingDB Entry DOI: 10.7270/Q2GT5N74
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase AKT1


(Homo sapiens (Human))
BDBM16935
PNG
(5-{5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridi...)
Show SMILES CCC1C(=O)Nc2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1
Show InChI InChI=1S/C26H26N4O2/c1-2-21-23-11-16(7-8-25(23)30-26(21)31)17-10-20(14-28-12-17)32-15-19(27)9-18-13-29-24-6-4-3-5-22(18)24/h3-8,10-14,19,21,29H,2,9,15,27H2,1H3,(H,30,31)/t19-,21?/m0/s1
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n/an/a 52.7n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of Akt


Eur J Med Chem 44: 4090-7 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.050
BindingDB Entry DOI: 10.7270/Q2GT5N74
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase AKT1


(Homo sapiens (Human))
BDBM16923
PNG
(5-{5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridi...)
Show SMILES N[C@H](COc1cncc(c1)-c1ccc2NC(=O)Cc2c1)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C24H22N4O2/c25-19(8-18-12-27-23-4-2-1-3-21(18)23)14-30-20-9-17(11-26-13-20)15-5-6-22-16(7-15)10-24(29)28-22/h1-7,9,11-13,19,27H,8,10,14,25H2,(H,28,29)/t19-/m0/s1
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n/an/a 3.20n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of Akt


Eur J Med Chem 44: 4090-7 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.050
BindingDB Entry DOI: 10.7270/Q2GT5N74
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase AKT1


(Homo sapiens (Human))
BDBM50298434
PNG
(5-(5-((S)-2-amino-3-(1H-indol-3-yl)propoxy)pyridin...)
Show SMILES N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(C3CC3)c2c1)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C27H26N4O2/c28-20(9-19-13-30-24-4-2-1-3-22(19)24)15-33-21-10-18(12-29-14-21)17-7-8-25-23(11-17)26(16-5-6-16)27(32)31-25/h1-4,7-8,10-14,16,20,26,30H,5-6,9,15,28H2,(H,31,32)/t20-,26?/m0/s1
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n/an/a 3.30n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of Akt


Eur J Med Chem 44: 4090-7 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.050
BindingDB Entry DOI: 10.7270/Q2GT5N74
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase AKT1


(Homo sapiens (Human))
BDBM50298435
PNG
(5-(5-((S)-2-amino-3-(1H-indol-3-yl)propoxy)pyridin...)
Show SMILES N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(c2c1)c1ccccc1)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C30H26N4O2/c31-23(12-22-16-33-27-9-5-4-8-25(22)27)18-36-24-13-21(15-32-17-24)20-10-11-28-26(14-20)29(30(35)34-28)19-6-2-1-3-7-19/h1-11,13-17,23,29,33H,12,18,31H2,(H,34,35)/t23-,29?/m0/s1
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n/an/a 5.90n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of Akt


Eur J Med Chem 44: 4090-7 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.050
BindingDB Entry DOI: 10.7270/Q2GT5N74
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase AKT1


(Homo sapiens (Human))
BDBM50298437
PNG
(5-(5-((S)-2-amino-3-(1H-indol-3-yl)propoxy)pyridin...)
Show SMILES N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(c2c1)c1ccccn1)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C29H25N5O2/c30-21(11-20-15-33-25-6-2-1-5-23(20)25)17-36-22-12-19(14-31-16-22)18-8-9-26-24(13-18)28(29(35)34-26)27-7-3-4-10-32-27/h1-10,12-16,21,28,33H,11,17,30H2,(H,34,35)/t21-,28?/m0/s1
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n/an/a 10.3n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of Akt


Eur J Med Chem 44: 4090-7 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.050
BindingDB Entry DOI: 10.7270/Q2GT5N74
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase AKT1


(Homo sapiens (Human))
BDBM50298438
PNG
(5-(5-((S)-2-amino-3-(1H-indol-3-yl)propoxy)pyridin...)
Show SMILES N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(c3ccc[nH]3)c2c1)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C28H25N5O2/c29-20(10-19-14-32-24-5-2-1-4-22(19)24)16-35-21-11-18(13-30-15-21)17-7-8-25-23(12-17)27(28(34)33-25)26-6-3-9-31-26/h1-9,11-15,20,27,31-32H,10,16,29H2,(H,33,34)/t20-,27?/m0/s1
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n/an/a 1.5n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of Akt


Eur J Med Chem 44: 4090-7 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.050
BindingDB Entry DOI: 10.7270/Q2GT5N74
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase AKT1


(Homo sapiens (Human))
BDBM50298439
PNG
(5-(5-((S)-2-amino-3-(1H-indol-3-yl)propoxy)pyridin...)
Show SMILES Cn1cccc1C1C(=O)Nc2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1
Show InChI InChI=1S/C29H27N5O2/c1-34-10-4-7-27(34)28-24-13-18(8-9-26(24)33-29(28)35)19-12-22(16-31-14-19)36-17-21(30)11-20-15-32-25-6-3-2-5-23(20)25/h2-10,12-16,21,28,32H,11,17,30H2,1H3,(H,33,35)/t21-,28?/m0/s1
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n/an/a 8.20n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of Akt


Eur J Med Chem 44: 4090-7 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.050
BindingDB Entry DOI: 10.7270/Q2GT5N74
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase AKT1


(Homo sapiens (Human))
BDBM50298440
PNG
(5-(5-((S)-2-amino-3-(1H-indol-3-yl)propoxy)pyridin...)
Show SMILES N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(c3c[nH]c4ccccc34)c2c1)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C32H27N5O2/c33-22(11-21-15-35-28-7-3-1-5-24(21)28)18-39-23-12-20(14-34-16-23)19-9-10-30-26(13-19)31(32(38)37-30)27-17-36-29-8-4-2-6-25(27)29/h1-10,12-17,22,31,35-36H,11,18,33H2,(H,37,38)/t22-,31?/m0/s1
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n/an/a 153n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of Akt


Eur J Med Chem 44: 4090-7 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.050
BindingDB Entry DOI: 10.7270/Q2GT5N74
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase AKT1


(Homo sapiens (Human))
BDBM50298441
PNG
(5-(5-((S)-2-amino-3-(1H-indol-3-yl)propoxy)pyridin...)
Show SMILES N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(c3ncc[nH]3)c2c1)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C27H24N6O2/c28-19(9-18-13-32-23-4-2-1-3-21(18)23)15-35-20-10-17(12-29-14-20)16-5-6-24-22(11-16)25(27(34)33-24)26-30-7-8-31-26/h1-8,10-14,19,25,32H,9,15,28H2,(H,30,31)(H,33,34)/t19-,25?/m0/s1
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n/an/a 7.20n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of Akt


Eur J Med Chem 44: 4090-7 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.050
BindingDB Entry DOI: 10.7270/Q2GT5N74
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase AKT1


(Homo sapiens (Human))
BDBM50298442
PNG
(5-(5-((S)-2-amino-3-(1H-indol-3-yl)propoxy)pyridin...)
Show SMILES CCc1c(C)[nH]c(C2C(=O)Nc3ccc(cc23)-c2cncc(OC[C@@H](N)Cc3c[nH]c4ccccc34)c2)c1C
Show InChI InChI=1S/C32H33N5O2/c1-4-25-18(2)31(36-19(25)3)30-27-13-20(9-10-29(27)37-32(30)38)21-12-24(16-34-14-21)39-17-23(33)11-22-15-35-28-8-6-5-7-26(22)28/h5-10,12-16,23,30,35-36H,4,11,17,33H2,1-3H3,(H,37,38)/t23-,30?/m0/s1
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 40.3n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of Akt


Eur J Med Chem 44: 4090-7 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.050
BindingDB Entry DOI: 10.7270/Q2GT5N74
More data for this
Ligand-Target Pair
Protein kinase B (Akt 1)


(Homo sapiens (Human))
BDBM16923
PNG
(5-{5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridi...)
Show SMILES N[C@H](COc1cncc(c1)-c1ccc2NC(=O)Cc2c1)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C24H22N4O2/c25-19(8-18-12-27-23-4-2-1-3-21(18)23)14-30-20-9-17(11-26-13-20)15-5-6-22-16(7-15)10-24(29)28-22/h1-7,9,11-13,19,27H,8,10,14,25H2,(H,28,29)/t19-/m0/s1
PDB
MMDB

B.MOAD
GoogleScholar
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PC sid
UniChem

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Article
PubMed
n/an/a 3.20n/an/an/an/a7.522



Abbott Laboratories



Assay Description
The kinase assay uses His-Akt1 and a biotinylated peptide as substrate. The biotinylated peptides were immobilized on streptavidin-coated FLASH plat...


Bioorg Med Chem Lett 16: 3424-9 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.005
BindingDB Entry DOI: 10.7270/Q2K072JJ
More data for this
Ligand-Target Pair