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PubMed code 21353784

Compile data set for download or QSAR
Found 35 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338966
PNG
(CHEMBL1685065 | Phosphatidylinositol(3,4,5)-trisph...)
Show SMILES CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(O)(=O)O[C@@H]1[C@H](O)[C@H](OP(O)(O)=O)[C@@H](OP(O)(O)=O)[C@H](OP(O)(O)=O)[C@H]1O)OC(=O)CCCCCCCCCCCCCCC |r|
Show InChI InChI=1S/C41H82O22P4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(42)57-31-33(59-35(43)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)32-58-67(55,56)63-38-36(44)39(60-64(46,47)48)41(62-66(52,53)54)40(37(38)45)61-65(49,50)51/h33,36-41,44-45H,3-32H2,1-2H3,(H,55,56)(H2,46,47,48)(H2,49,50,51)(H2,52,53,54)/t33-,36+,37+,38-,39+,40-,41-/m1/s1
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 500n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338967
PNG
(CHEMBL1685066 | D-3-deoxyphosphatidylinositol ethe...)
Show SMILES CCCCCCCCCCCCCCCCCCOC[C@H](COP(O)(=O)O[C@@H]1[C@H](O)C[C@@H](O)[C@H](O)[C@H]1O)OC |r|
Show InChI InChI=1S/C28H57O10P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-36-21-23(35-2)22-37-39(33,34)38-28-25(30)20-24(29)26(31)27(28)32/h23-32H,3-22H2,1-2H3,(H,33,34)/t23-,24-,25-,26+,27-,28-/m1/s1
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 1.60E+3n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50304369
PNG
(4-dodecyl-N-(1,3,4-thiadiazol-2-yl)benzenesulfonam...)
Show SMILES CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nncs1
Show InChI InChI=1S/C20H31N3O2S2/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-15-19(16-14-18)27(24,25)23-20-22-21-17-26-20/h13-17H,2-12H2,1H3,(H,22,23)
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 2.40E+3n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338956
PNG
(CHEMBL1685055 | Ethyl 2-(5-(4-Dodecylphenylsulfona...)
Show SMILES CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nnc(CC(=O)OCC)s1
Show InChI InChI=1S/C24H37N3O4S2/c1-3-5-6-7-8-9-10-11-12-13-14-20-15-17-21(18-16-20)33(29,30)27-24-26-25-22(32-24)19-23(28)31-4-2/h15-18H,3-14,19H2,1-2H3,(H,26,27)
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 4.30E+3n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338955
PNG
(2-(5-(4-Dodecylphenylsulfonamido)-1,3,4-thiadiazol...)
Show SMILES CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nnc(CC(O)=O)s1
Show InChI InChI=1S/C22H33N3O4S2/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-15-19(16-14-18)31(28,29)25-22-24-23-20(30-22)17-21(26)27/h13-16H,2-12,17H2,1H3,(H,24,25)(H,26,27)
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 5.00E+3n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338949
PNG
(4-Tetradecyl-N-(1,3,4-thiadiazol-2-yl)benzenesulfo...)
Show SMILES CCCCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nncs1
Show InChI InChI=1S/C22H35N3O2S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-20-15-17-21(18-16-20)29(26,27)25-22-24-23-19-28-22/h15-19H,2-14H2,1H3,(H,24,25)
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 5.60E+3n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338959
PNG
(5-(4-Dodecylphenylsulfonamido)-1,3,4-thiadiazole-2...)
Show SMILES CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C20H32N4O4S3/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(16-14-17)31(27,28)24-19-22-23-20(29-19)30(21,25)26/h13-16H,2-12H2,1H3,(H,22,24)(H2,21,25,26)
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 6.00E+3n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338953
PNG
(4-Dodecyl-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzene...)
Show SMILES CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nnc(CC)s1
Show InChI InChI=1S/C22H35N3O2S2/c1-3-5-6-7-8-9-10-11-12-13-14-19-15-17-20(18-16-19)29(26,27)25-22-24-23-21(4-2)28-22/h15-18H,3-14H2,1-2H3,(H,24,25)
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 7.00E+3n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338958
PNG
(4-Dodecyl-N-(5-(hydroxymethyl)-1,3,4-thiadiazol-2-...)
Show SMILES CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nnc(CO)s1
Show InChI InChI=1S/C21H33N3O3S2/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-15-19(16-14-18)29(26,27)24-21-23-22-20(17-25)28-21/h13-16,25H,2-12,17H2,1H3,(H,23,24)
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 7.50E+3n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338950
PNG
(4-Hexadecyl-N-(1,3,4-thiadiazol-2-yl)benzenesulfon...)
Show SMILES CCCCCCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nncs1
Show InChI InChI=1S/C24H39N3O2S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-22-17-19-23(20-18-22)31(28,29)27-24-26-25-21-30-24/h17-21H,2-16H2,1H3,(H,26,27)
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 7.60E+3n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338939
PNG
(CHEMBL1685039 | N-(4-(N-(5-Ethyl-1,3,4-thiadiazol-...)
Show SMILES CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nnc(CC)s1
Show InChI InChI=1S/C20H30N4O3S2/c1-3-5-6-7-8-9-10-11-18(25)21-16-12-14-17(15-13-16)29(26,27)24-20-23-22-19(4-2)28-20/h12-15H,3-11H2,1-2H3,(H,21,25)(H,23,24)
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 8.00E+3n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338965
PNG
(3-Dodecyl-N-(1,3,4-thiadiazol-2-yl)benzenesulfonam...)
Show SMILES CCCCCCCCCCCCc1cccc(c1)S(=O)(=O)Nc1nncs1
Show InChI InChI=1S/C20H31N3O2S2/c1-2-3-4-5-6-7-8-9-10-11-13-18-14-12-15-19(16-18)27(24,25)23-20-22-21-17-26-20/h12,14-17H,2-11,13H2,1H3,(H,22,23)
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 8.00E+3n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338942
PNG
(CHEMBL1685042 | Ethyl 2-(5-(4-Decanamidophenylsulf...)
Show SMILES CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nnc(CC(=O)OCC)s1
Show InChI InChI=1S/C22H32N4O5S2/c1-3-5-6-7-8-9-10-11-19(27)23-17-12-14-18(15-13-17)33(29,30)26-22-25-24-20(32-22)16-21(28)31-4-2/h12-15H,3-11,16H2,1-2H3,(H,23,27)(H,25,26)
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 9.00E+3n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338943
PNG
(CHEMBL1685043 | Ethyl 5-(4-Decanamidophenylsulfona...)
Show SMILES CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nnc(s1)C(=O)OCC
Show InChI InChI=1S/C21H30N4O5S2/c1-3-5-6-7-8-9-10-11-18(26)22-16-12-14-17(15-13-16)32(28,29)25-21-24-23-19(31-21)20(27)30-4-2/h12-15H,3-11H2,1-2H3,(H,22,26)(H,24,25)
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 9.00E+3n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338941
PNG
(2-(5-(4-Decanamidophenylsulfonamido)-1,3,4-thiadia...)
Show SMILES CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nnc(CC(O)=O)s1
Show InChI InChI=1S/C20H28N4O5S2/c1-2-3-4-5-6-7-8-9-17(25)21-15-10-12-16(13-11-15)31(28,29)24-20-23-22-18(30-20)14-19(26)27/h10-13H,2-9,14H2,1H3,(H,21,25)(H,23,24)(H,26,27)
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 1.00E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338944
PNG
(CHEMBL1685044 | N-(4-(N-(5-(hydroxymethyl)-1,3,4-t...)
Show SMILES CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nnc(CO)s1
Show InChI InChI=1S/C19H28N4O4S2/c1-2-3-4-5-6-7-8-9-17(25)20-15-10-12-16(13-11-15)29(26,27)23-19-22-21-18(14-24)28-19/h10-13,24H,2-9,14H2,1H3,(H,20,25)(H,22,23)
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 1.10E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338938
PNG
(CHEMBL1685038 | N-(4-(N-(5-Methyl-1,3,4-thiadiazol...)
Show SMILES CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nnc(C)s1
Show InChI InChI=1S/C19H28N4O3S2/c1-3-4-5-6-7-8-9-10-18(24)20-16-11-13-17(14-12-16)28(25,26)23-19-22-21-15(2)27-19/h11-14H,3-10H2,1-2H3,(H,20,24)(H,22,23)
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 1.10E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338951
PNG
(4-Octadecyl-N-(1,3,4-thiadiazol-2-yl)benzenesulfon...)
Show SMILES CCCCCCCCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nncs1
Show InChI InChI=1S/C26H43N3O2S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-19-21-25(22-20-24)33(30,31)29-26-28-27-23-32-26/h19-23H,2-18H2,1H3,(H,28,29)
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 1.20E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338940
PNG
(CHEMBL1685040 | N-(4-(N-(5-tert-Butyl-1,3,4-thiadi...)
Show SMILES CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nnc(s1)C(C)(C)C
Show InChI InChI=1S/C22H34N4O3S2/c1-5-6-7-8-9-10-11-12-19(27)23-17-13-15-18(16-14-17)31(28,29)26-21-25-24-20(30-21)22(2,3)4/h13-16H,5-12H2,1-4H3,(H,23,27)(H,25,26)
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PubMed
 1.20E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338961
PNG
(CHEMBL1685060 | N-(5-Ethyl-1,3,4-thiadiazol-2-yl)b...)
Show SMILES CCc1nnc(NS(=O)(=O)c2ccc(cc2)-c2ccccc2)s1
Show InChI InChI=1S/C16H15N3O2S2/c1-2-15-17-18-16(22-15)19-23(20,21)14-10-8-13(9-11-14)12-6-4-3-5-7-12/h3-11H,2H2,1H3,(H,18,19)
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PubMed
 1.70E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338964
PNG
(CHEMBL1685063 | ortho-Dodecyl-N-(1,3,4-thiadiazol-...)
Show SMILES CCCCCCCCCCCCc1ccccc1S(=O)(=O)Nc1nncs1
Show InChI InChI=1S/C20H31N3O2S2/c1-2-3-4-5-6-7-8-9-10-11-14-18-15-12-13-16-19(18)27(24,25)23-20-22-21-17-26-20/h12-13,15-17H,2-11,14H2,1H3,(H,22,23)
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PubMed
 1.80E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338960
PNG
(CHEMBL1685059 | N-(1,3,4-Thiadiazol-2-yl)biphenyl-...)
Show SMILES O=S(=O)(Nc1nncs1)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C14H11N3O2S2/c18-21(19,17-14-16-15-10-20-14)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-10H,(H,16,17)
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 1.90E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338957
PNG
(CHEMBL1685056 | Ethyl 5-(4-Dodecylphenylsulfonamid...)
Show SMILES CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nnc(s1)C(=O)OCC
Show InChI InChI=1S/C23H35N3O4S2/c1-3-5-6-7-8-9-10-11-12-13-14-19-15-17-20(18-16-19)32(28,29)26-23-25-24-21(31-23)22(27)30-4-2/h15-18H,3-14H2,1-2H3,(H,25,26)
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 1.90E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50304368
PNG
(CHEMBL595582 | N-(4-(N-1,3,4-thiadiazol-2-ylsulfam...)
Show SMILES CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nncs1
Show InChI InChI=1S/C18H26N4O3S2/c1-2-3-4-5-6-7-8-9-17(23)20-15-10-12-16(13-11-15)27(24,25)22-18-21-19-14-26-18/h10-14H,2-9H2,1H3,(H,20,23)(H,21,22)
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PubMed
 2.20E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338962
PNG
(2-(5-(Biphen-4-ylsulfonamido)-1,3,4-thiadiazol-2-y...)
Show SMILES OCc1nnc(NS(=O)(=O)c2ccc(cc2)-c2ccccc2)s1
Show InChI InChI=1S/C15H13N3O3S2/c19-10-14-16-17-15(22-14)18-23(20,21)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9,19H,10H2,(H,17,18)
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PubMed
 4.00E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50304371
PNG
(CHEMBL611216 | N-(4-(N-1,3,4-thiadiazol-2-ylsulfam...)
Show SMILES COCCOCCOCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nncs1
Show InChI InChI=1S/C15H20N4O6S2/c1-23-6-7-24-8-9-25-10-14(20)17-12-2-4-13(5-3-12)27(21,22)19-15-18-16-11-26-15/h2-5,11H,6-10H2,1H3,(H,17,20)(H,18,19)
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PubMed
 4.10E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338954
PNG
(CHEMBL1685054 | N-(5-tert-Butyl-1,3,4-thiadiazol-2...)
Show SMILES CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nnc(s1)C(C)(C)C
Show InChI InChI=1S/C24H39N3O2S2/c1-5-6-7-8-9-10-11-12-13-14-15-20-16-18-21(19-17-20)31(28,29)27-23-26-25-22(30-23)24(2,3)4/h16-19H,5-15H2,1-4H3,(H,26,27)
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>5.00E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338948
PNG
(4-Octyl-N-(1,3,4-thiadiazol-2-yl)benzenesulfonamid...)
Show SMILES CCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nncs1
Show InChI InChI=1S/C16H23N3O2S2/c1-2-3-4-5-6-7-8-14-9-11-15(12-10-14)23(20,21)19-16-18-17-13-22-16/h9-13H,2-8H2,1H3,(H,18,19)
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>5.00E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338946
PNG
(4-Butyl-N-(1,3,4-thiadiazol-2-yl)benzenesulfonamid...)
Show SMILES CCCCc1ccc(cc1)S(=O)(=O)Nc1nncs1
Show InChI InChI=1S/C12H15N3O2S2/c1-2-3-4-10-5-7-11(8-6-10)19(16,17)15-12-14-13-9-18-12/h5-9H,2-4H2,1H3,(H,14,15)
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>5.00E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50304370
PNG
(CHEMBL593946 | N-(4-(N-1,3,4-thiadiazol-2-ylsulfam...)
Show SMILES CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nncs1
Show InChI InChI=1S/C10H10N4O3S2/c1-7(15)12-8-2-4-9(5-3-8)19(16,17)14-10-13-11-6-18-10/h2-6H,1H3,(H,12,15)(H,13,14)
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>5.00E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338963
PNG
(CHEMBL1685062 | para-Dodecyl-N-phenylbenzenesulfon...)
Show SMILES CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1ccccc1
Show InChI InChI=1S/C24H35NO2S/c1-2-3-4-5-6-7-8-9-10-12-15-22-18-20-24(21-19-22)28(26,27)25-23-16-13-11-14-17-23/h11,13-14,16-21,25H,2-10,12,15H2,1H3
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>5.00E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50034417
PNG
(4-Amino-N-[1,3,4]thiadiazol-2-yl-benzenesulfonamid...)
Show SMILES Nc1ccc(cc1)S(=O)(=O)Nc1nncs1
Show InChI InChI=1S/C8H8N4O2S2/c9-6-1-3-7(4-2-6)16(13,14)12-8-11-10-5-15-8/h1-5H,9H2,(H,11,12)
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>5.00E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338945
PNG
(CHEMBL1685045 | N-(4-(N-(5-Sulfamoyl-1,3,4-thiadia...)
Show SMILES CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C18H27N5O5S3/c1-2-3-4-5-6-7-8-9-16(24)20-14-10-12-15(13-11-14)31(27,28)23-17-21-22-18(29-17)30(19,25)26/h10-13H,2-9H2,1H3,(H,20,24)(H,21,23)(H2,19,25,26)
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>5.00E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338947
PNG
(4-Hexyl-N-(1,3,4-thiadiazol-2-yl)benzenesulfonamid...)
Show SMILES CCCCCCc1ccc(cc1)S(=O)(=O)Nc1nncs1
Show InChI InChI=1S/C14H19N3O2S2/c1-2-3-4-5-6-12-7-9-13(10-8-12)21(18,19)17-14-16-15-11-20-14/h7-11H,2-6H2,1H3,(H,16,17)
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>5.00E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Mus musculus)		BDBM50338952
PNG
(4-Dodecyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzen...)
Show SMILES CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nnc(C)s1
Show InChI InChI=1S/C21H33N3O2S2/c1-3-4-5-6-7-8-9-10-11-12-13-19-14-16-20(17-15-19)28(25,26)24-21-23-22-18(2)27-21/h14-17H,3-13H2,1-2H3,(H,23,24)
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>5.00E+4n/an/an/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Displacement of biotinylated phosphatidylinositol-3,4,5-phosphate from mouse AKT1 PH domain by surface plasmon resonance competitive binding assay

Bioorg Med Chem 19: 2046-54 (2011)


Article DOI: 10.1016/j.bmc.2011.01.049
BindingDB Entry DOI: 10.7270/Q2TQ61TR
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%