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Compile Data Set for Download or QSAR

Found 90 hits with Last Name = 'dunn' and Initial = 'se'   
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
Protein-arginine deiminase type-2


(Mus musculus)
BDBM50248829
PNG
(CHEMBL4084229)
Show SMILES CC1(C)NC(=O)N(CCc2nnn[nH]2)C1=O
Show InChI InChI=1S/C8H12N6O2/c1-8(2)6(15)14(7(16)9-8)4-3-5-10-12-13-11-5/h3-4H2,1-2H3,(H,9,16)(H,10,11,12,13)
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3.00E+4n/an/an/an/an/an/an/an/a



University Health Network

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant mouse N-terminal GST-tagged PAD2 expressed in baculovirus infected Sf9 cells using benzoyl arginine ethyl ester...


Bioorg Med Chem 25: 2643-2656 (2017)


Article DOI: 10.1016/j.bmc.2017.03.006
BindingDB Entry DOI: 10.7270/Q2HM5BW5
More data for this
Ligand-Target Pair
Protein-arginine deiminase type-4


(Homo sapiens (Human))
BDBM50248829
PNG
(CHEMBL4084229)
Show SMILES CC1(C)NC(=O)N(CCc2nnn[nH]2)C1=O
Show InChI InChI=1S/C8H12N6O2/c1-8(2)6(15)14(7(16)9-8)4-3-5-10-12-13-11-5/h3-4H2,1-2H3,(H,9,16)(H,10,11,12,13)
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4.70E+4n/an/an/an/an/an/an/an/a



University Health Network

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant human N-terminal GST-tagged PAD4 expressed in baculovirus infected Sf9 cells using benzoyl arginine ethylester ...


Bioorg Med Chem 25: 2643-2656 (2017)


Article DOI: 10.1016/j.bmc.2017.03.006
BindingDB Entry DOI: 10.7270/Q2HM5BW5
More data for this
Ligand-Target Pair
Protein-arginine deiminase type-2


(Mus musculus)
BDBM50426302
PNG
(CHEMBL2312698)
Show SMILES CC1(C)NC(=O)N(CN2CCNCC2)C1=O
Show InChI InChI=1S/C10H18N4O2/c1-10(2)8(15)14(9(16)12-10)7-13-5-3-11-4-6-13/h11H,3-7H2,1-2H3,(H,12,16)
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1.79E+5n/an/an/an/an/an/an/an/a



University Health Network

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant mouse N-terminal GST-tagged PAD2 expressed in baculovirus infected Sf9 cells using benzoyl arginine ethyl ester...


Bioorg Med Chem 25: 2643-2656 (2017)


Article DOI: 10.1016/j.bmc.2017.03.006
BindingDB Entry DOI: 10.7270/Q2HM5BW5
More data for this
Ligand-Target Pair
Protein-arginine deiminase type-4


(Homo sapiens (Human))
BDBM50426302
PNG
(CHEMBL2312698)
Show SMILES CC1(C)NC(=O)N(CN2CCNCC2)C1=O
Show InChI InChI=1S/C10H18N4O2/c1-10(2)8(15)14(9(16)12-10)7-13-5-3-11-4-6-13/h11H,3-7H2,1-2H3,(H,12,16)
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1.83E+5n/an/an/an/an/an/an/an/a



University Health Network

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant human N-terminal GST-tagged PAD4 expressed in baculovirus infected Sf9 cells using benzoyl arginine ethylester ...


Bioorg Med Chem 25: 2643-2656 (2017)


Article DOI: 10.1016/j.bmc.2017.03.006
BindingDB Entry DOI: 10.7270/Q2HM5BW5
More data for this
Ligand-Target Pair
Protein-arginine deiminase type-1


(Homo sapiens (Human))
BDBM50248829
PNG
(CHEMBL4084229)
Show SMILES CC1(C)NC(=O)N(CCc2nnn[nH]2)C1=O
Show InChI InChI=1S/C8H12N6O2/c1-8(2)6(15)14(7(16)9-8)4-3-5-10-12-13-11-5/h3-4H2,1-2H3,(H,9,16)(H,10,11,12,13)
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3.84E+5n/an/an/an/an/an/an/an/a



University Health Network

Curated by ChEMBL


Assay Description
Inhibition of human PAD1 using BAEE as substrate preincubated for 30 mins followed by substrate addition measured after 30 mins by colorimetric assay


Bioorg Med Chem 25: 2643-2656 (2017)


Article DOI: 10.1016/j.bmc.2017.03.006
BindingDB Entry DOI: 10.7270/Q2HM5BW5
More data for this
Ligand-Target Pair
Protein-arginine deiminase type-1


(Homo sapiens (Human))
BDBM50426302
PNG
(CHEMBL2312698)
Show SMILES CC1(C)NC(=O)N(CN2CCNCC2)C1=O
Show InChI InChI=1S/C10H18N4O2/c1-10(2)8(15)14(9(16)12-10)7-13-5-3-11-4-6-13/h11H,3-7H2,1-2H3,(H,12,16)
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4.45E+5n/an/an/an/an/an/an/an/a



University Health Network

Curated by ChEMBL


Assay Description
Inhibition of human PAD1 using BAEE as substrate preincubated for 30 mins followed by substrate addition measured after 30 mins by colorimetric assay


Bioorg Med Chem 25: 2643-2656 (2017)


Article DOI: 10.1016/j.bmc.2017.03.006
BindingDB Entry DOI: 10.7270/Q2HM5BW5
More data for this
Ligand-Target Pair
Protein-arginine deiminase type-1


(Homo sapiens (Human))
BDBM50248824
PNG
(CHEMBL4059499)
Show SMILES CC1(C)NC(=O)N(CCN2CCOCC2)C1=O
Show InChI InChI=1S/C11H19N3O3/c1-11(2)9(15)14(10(16)12-11)4-3-13-5-7-17-8-6-13/h3-8H2,1-2H3,(H,12,16)
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6.02E+5n/an/an/an/an/an/an/an/a



University Health Network

Curated by ChEMBL


Assay Description
Inhibition of human PAD1 using BAEE as substrate preincubated for 30 mins followed by substrate addition measured after 30 mins by colorimetric assay


Bioorg Med Chem 25: 2643-2656 (2017)


Article DOI: 10.1016/j.bmc.2017.03.006
BindingDB Entry DOI: 10.7270/Q2HM5BW5
More data for this
Ligand-Target Pair
Protein-arginine deiminase type-4


(Homo sapiens (Human))
BDBM50248830
PNG
(CHEMBL4089583)
Show SMILES CC1(C)NC(=O)N(CCn2ccnc2)C1=O
Show InChI InChI=1S/C10H14N4O2/c1-10(2)8(15)14(9(16)12-10)6-5-13-4-3-11-7-13/h3-4,7H,5-6H2,1-2H3,(H,12,16)
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6.32E+5n/an/an/an/an/an/an/an/a



University Health Network

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant human N-terminal GST-tagged PAD4 expressed in baculovirus infected Sf9 cells using benzoyl arginine ethylester ...


Bioorg Med Chem 25: 2643-2656 (2017)


Article DOI: 10.1016/j.bmc.2017.03.006
BindingDB Entry DOI: 10.7270/Q2HM5BW5
More data for this
Ligand-Target Pair
Protein-arginine deiminase type-2


(Mus musculus)
BDBM50248832
PNG
(CHEMBL4084379)
Show SMILES CC1(C)NC(=O)N(CCN2CCNCC2)C1=O
Show InChI InChI=1S/C11H20N4O2/c1-11(2)9(16)15(10(17)13-11)8-7-14-5-3-12-4-6-14/h12H,3-8H2,1-2H3,(H,13,17)
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7.14E+5n/an/an/an/an/an/an/an/a



University Health Network

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant mouse N-terminal GST-tagged PAD2 expressed in baculovirus infected Sf9 cells using benzoyl arginine ethyl ester...


Bioorg Med Chem 25: 2643-2656 (2017)


Article DOI: 10.1016/j.bmc.2017.03.006
BindingDB Entry DOI: 10.7270/Q2HM5BW5
More data for this
Ligand-Target Pair
Protein-arginine deiminase type-4


(Homo sapiens (Human))
BDBM50248824
PNG
(CHEMBL4059499)
Show SMILES CC1(C)NC(=O)N(CCN2CCOCC2)C1=O
Show InChI InChI=1S/C11H19N3O3/c1-11(2)9(15)14(10(16)12-11)4-3-13-5-7-17-8-6-13/h3-8H2,1-2H3,(H,12,16)
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1.43E+6n/an/an/an/an/an/an/an/a



University Health Network

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant human N-terminal GST-tagged PAD4 expressed in baculovirus infected Sf9 cells using benzoyl arginine ethylester ...


Bioorg Med Chem 25: 2643-2656 (2017)


Article DOI: 10.1016/j.bmc.2017.03.006
BindingDB Entry DOI: 10.7270/Q2HM5BW5
More data for this
Ligand-Target Pair
Protein-arginine deiminase type-1


(Homo sapiens (Human))
BDBM50248814
PNG
(CHEMBL4070114)
Show SMILES Cc1nccn1CCN1C(=O)NC(C)(C)C1=O
Show InChI InChI=1S/C11H16N4O2/c1-8-12-4-5-14(8)6-7-15-9(16)11(2,3)13-10(15)17/h4-5H,6-7H2,1-3H3,(H,13,17)
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2.42E+6n/an/an/an/an/an/an/an/a



University Health Network

Curated by ChEMBL


Assay Description
Inhibition of human PAD1 using BAEE as substrate preincubated for 30 mins followed by substrate addition measured after 30 mins by colorimetric assay


Bioorg Med Chem 25: 2643-2656 (2017)


Article DOI: 10.1016/j.bmc.2017.03.006
BindingDB Entry DOI: 10.7270/Q2HM5BW5
More data for this
Ligand-Target Pair
Protein-arginine deiminase type-2


(Mus musculus)
BDBM50248830
PNG
(CHEMBL4089583)
Show SMILES CC1(C)NC(=O)N(CCn2ccnc2)C1=O
Show InChI InChI=1S/C10H14N4O2/c1-10(2)8(15)14(9(16)12-10)6-5-13-4-3-11-7-13/h3-4,7H,5-6H2,1-2H3,(H,12,16)
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4.62E+6n/an/an/an/an/an/an/an/a



University Health Network

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant mouse N-terminal GST-tagged PAD2 expressed in baculovirus infected Sf9 cells using benzoyl arginine ethyl ester...


Bioorg Med Chem 25: 2643-2656 (2017)


Article DOI: 10.1016/j.bmc.2017.03.006
BindingDB Entry DOI: 10.7270/Q2HM5BW5
More data for this
Ligand-Target Pair
Protein-arginine deiminase type-4


(Homo sapiens (Human))
BDBM50248831
PNG
(CHEMBL4102346)
Show SMILES CC1(C)NC(=O)N(CCN2CCCC2)C1=O
Show InChI InChI=1S/C11H19N3O2/c1-11(2)9(15)14(10(16)12-11)8-7-13-5-3-4-6-13/h3-8H2,1-2H3,(H,12,16)
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4.64E+6n/an/an/an/an/an/an/an/a



University Health Network

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant human N-terminal GST-tagged PAD4 expressed in baculovirus infected Sf9 cells using benzoyl arginine ethylester ...


Bioorg Med Chem 25: 2643-2656 (2017)


Article DOI: 10.1016/j.bmc.2017.03.006
BindingDB Entry DOI: 10.7270/Q2HM5BW5
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-6


(Homo sapiens (Human))
BDBM286091
PNG
((R)¿N-(1-(4-aminobenzyl)-1H-pyrazol-4-yl)-9-methyl...)
Show SMILES C[C@@H]1CNC(=O)c2cc3ccc(nc3n12)C(=O)Nc1cnn(Cc2ccc(N)cc2)c1 |r|
Show InChI InChI=1S/C27H29N7O4/c1-16-12-28-25(36)22-11-18-7-10-21(32-23(18)34(16)22)24(35)30-20-13-29-33(15-20)14-17-5-8-19(9-6-17)31-26(37)38-27(2,3)4/h5-11,13,15-16H,12,14H2,1-4H3,(H,28,36)(H,30,35)(H,31,37)/t16-/m1/s1
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n/an/a 0.300n/an/an/an/an/an/a



PHOENIX MOLECULAR DESIGN

US Patent


Assay Description
Radioisotope assays (SignalChem) were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radio...


US Patent US9771366 (2017)


BindingDB Entry DOI: 10.7270/Q2862JK5
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-6


(Homo sapiens (Human))
BDBM286091
PNG
((R)¿N-(1-(4-aminobenzyl)-1H-pyrazol-4-yl)-9-methyl...)
Show SMILES C[C@@H]1CNC(=O)c2cc3ccc(nc3n12)C(=O)Nc1cnn(Cc2ccc(N)cc2)c1 |r|
Show InChI InChI=1S/C27H29N7O4/c1-16-12-28-25(36)22-11-18-7-10-21(32-23(18)34(16)22)24(35)30-20-13-29-33(15-20)14-17-5-8-19(9-6-17)31-26(37)38-27(2,3)4/h5-11,13,15-16H,12,14H2,1-4H3,(H,28,36)(H,30,35)(H,31,37)/t16-/m1/s1
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PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM286091
PNG
((R)¿N-(1-(4-aminobenzyl)-1H-pyrazol-4-yl)-9-methyl...)
Show SMILES C[C@@H]1CNC(=O)c2cc3ccc(nc3n12)C(=O)Nc1cnn(Cc2ccc(N)cc2)c1 |r|
Show InChI InChI=1S/C27H29N7O4/c1-16-12-28-25(36)22-11-18-7-10-21(32-23(18)34(16)22)24(35)30-20-13-29-33(15-20)14-17-5-8-19(9-6-17)31-26(37)38-27(2,3)4/h5-11,13,15-16H,12,14H2,1-4H3,(H,28,36)(H,30,35)(H,31,37)/t16-/m1/s1
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PHOENIX MOLECULAR DESIGN

US Patent


Assay Description
Radioisotope assays (SignalChem) were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radio...


US Patent US9771366 (2017)


BindingDB Entry DOI: 10.7270/Q2862JK5
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM286091
PNG
((R)¿N-(1-(4-aminobenzyl)-1H-pyrazol-4-yl)-9-methyl...)
Show SMILES C[C@@H]1CNC(=O)c2cc3ccc(nc3n12)C(=O)Nc1cnn(Cc2ccc(N)cc2)c1 |r|
Show InChI InChI=1S/C27H29N7O4/c1-16-12-28-25(36)22-11-18-7-10-21(32-23(18)34(16)22)24(35)30-20-13-29-33(15-20)14-17-5-8-19(9-6-17)31-26(37)38-27(2,3)4/h5-11,13,15-16H,12,14H2,1-4H3,(H,28,36)(H,30,35)(H,31,37)/t16-/m1/s1
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PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-1


(Homo sapiens (Human))
BDBM286091
PNG
((R)¿N-(1-(4-aminobenzyl)-1H-pyrazol-4-yl)-9-methyl...)
Show SMILES C[C@@H]1CNC(=O)c2cc3ccc(nc3n12)C(=O)Nc1cnn(Cc2ccc(N)cc2)c1 |r|
Show InChI InChI=1S/C27H29N7O4/c1-16-12-28-25(36)22-11-18-7-10-21(32-23(18)34(16)22)24(35)30-20-13-29-33(15-20)14-17-5-8-19(9-6-17)31-26(37)38-27(2,3)4/h5-11,13,15-16H,12,14H2,1-4H3,(H,28,36)(H,30,35)(H,31,37)/t16-/m1/s1
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PHOENIX MOLECULAR DESIGN

US Patent


Assay Description
Radioisotope assays (SignalChem) were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radio...


US Patent US9771366 (2017)


BindingDB Entry DOI: 10.7270/Q2862JK5
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-1


(Homo sapiens (Human))
BDBM286091
PNG
((R)¿N-(1-(4-aminobenzyl)-1H-pyrazol-4-yl)-9-methyl...)
Show SMILES C[C@@H]1CNC(=O)c2cc3ccc(nc3n12)C(=O)Nc1cnn(Cc2ccc(N)cc2)c1 |r|
Show InChI InChI=1S/C27H29N7O4/c1-16-12-28-25(36)22-11-18-7-10-21(32-23(18)34(16)22)24(35)30-20-13-29-33(15-20)14-17-5-8-19(9-6-17)31-26(37)38-27(2,3)4/h5-11,13,15-16H,12,14H2,1-4H3,(H,28,36)(H,30,35)(H,31,37)/t16-/m1/s1
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PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM458758
PNG
((R)-1-benzyl-N-(9-methyl-6-oxo-6,7,8,9-tetrahydrop...)
Show SMILES C[C@@H]1CNC(=O)c2cc3ccc(NC(=O)c4cnn(Cc5ccccc5)c4)nc3n12 |r|
Show InChI InChI=1S/C22H20N6O2/c1-14-10-23-22(30)18-9-16-7-8-19(25-20(16)28(14)18)26-21(29)17-11-24-27(13-17)12-15-5-3-2-4-6-15/h2-9,11,13-14H,10,12H2,1H3,(H,23,30)(H,25,26,29)/t14-/m1/s1
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PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM342166
PNG
((R)-1-benzyl-N-(9-methyl-6-oxo-6,7,8,9-tetrahydrop...)
Show SMILES C[C@@H]1CNC(=O)c2cc3cc(NC(=O)c4cnn(Cc5ccccc5)c4)ccc3n12 |r|
Show InChI InChI=1S/C23H21N5O2/c1-15-11-24-23(30)21-10-17-9-19(7-8-20(17)28(15)21)26-22(29)18-12-25-27(14-18)13-16-5-3-2-4-6-16/h2-10,12,14-15H,11,13H2,1H3,(H,24,30)(H,26,29)/t15-/m1/s1
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n/an/a 6n/an/an/an/an/an/a



PHOENIX MOLECULAR DESIGN

US Patent


Assay Description
Radioisotope assays (SignalChem) were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radio...


US Patent US9771366 (2017)


BindingDB Entry DOI: 10.7270/Q2862JK5
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-6


(Homo sapiens (Human))
BDBM342166
PNG
((R)-1-benzyl-N-(9-methyl-6-oxo-6,7,8,9-tetrahydrop...)
Show SMILES C[C@@H]1CNC(=O)c2cc3cc(NC(=O)c4cnn(Cc5ccccc5)c4)ccc3n12 |r|
Show InChI InChI=1S/C23H21N5O2/c1-15-11-24-23(30)21-10-17-9-19(7-8-20(17)28(15)21)26-22(29)18-12-25-27(14-18)13-16-5-3-2-4-6-16/h2-10,12,14-15H,11,13H2,1H3,(H,24,30)(H,26,29)/t15-/m1/s1
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n/an/a 8n/an/an/an/an/an/a



PHOENIX MOLECULAR DESIGN

US Patent


Assay Description
Radioisotope assays (SignalChem) were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radio...


US Patent US9771366 (2017)


BindingDB Entry DOI: 10.7270/Q2862JK5
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-6


(Homo sapiens (Human))
BDBM458758
PNG
((R)-1-benzyl-N-(9-methyl-6-oxo-6,7,8,9-tetrahydrop...)
Show SMILES C[C@@H]1CNC(=O)c2cc3ccc(NC(=O)c4cnn(Cc5ccccc5)c4)nc3n12 |r|
Show InChI InChI=1S/C22H20N6O2/c1-14-10-23-22(30)18-9-16-7-8-19(25-20(16)28(14)18)26-21(29)17-11-24-27(13-17)12-15-5-3-2-4-6-15/h2-9,11,13-14H,10,12H2,1H3,(H,23,30)(H,25,26,29)/t14-/m1/s1
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n/an/a 8n/an/an/an/an/an/a



PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM286091
PNG
((R)¿N-(1-(4-aminobenzyl)-1H-pyrazol-4-yl)-9-methyl...)
Show SMILES C[C@@H]1CNC(=O)c2cc3ccc(nc3n12)C(=O)Nc1cnn(Cc2ccc(N)cc2)c1 |r|
Show InChI InChI=1S/C27H29N7O4/c1-16-12-28-25(36)22-11-18-7-10-21(32-23(18)34(16)22)24(35)30-20-13-29-33(15-20)14-17-5-8-19(9-6-17)31-26(37)38-27(2,3)4/h5-11,13,15-16H,12,14H2,1-4H3,(H,28,36)(H,30,35)(H,31,37)/t16-/m1/s1
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n/an/a 12n/an/an/an/an/an/a



PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM286090
PNG
((R)¿N-(1-(2-aminobenzyl)-1H-pyrazol-4-yl)-9-methyl...)
Show SMILES C[C@@H]1CNC(=O)c2cc3ccc(nc3n12)C(=O)Nc1cnn(Cc2ccccc2N)c1 |r|
Show InChI InChI=1S/C27H29N7O4/c1-16-12-28-25(36)22-11-17-9-10-21(31-23(17)34(16)22)24(35)30-19-13-29-33(15-19)14-18-7-5-6-8-20(18)32-26(37)38-27(2,3)4/h5-11,13,15-16H,12,14H2,1-4H3,(H,28,36)(H,30,35)(H,32,37)/t16-/m1/s1
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PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM286091
PNG
((R)¿N-(1-(4-aminobenzyl)-1H-pyrazol-4-yl)-9-methyl...)
Show SMILES C[C@@H]1CNC(=O)c2cc3ccc(nc3n12)C(=O)Nc1cnn(Cc2ccc(N)cc2)c1 |r|
Show InChI InChI=1S/C27H29N7O4/c1-16-12-28-25(36)22-11-18-7-10-21(32-23(18)34(16)22)24(35)30-20-13-29-33(15-20)14-17-5-8-19(9-6-17)31-26(37)38-27(2,3)4/h5-11,13,15-16H,12,14H2,1-4H3,(H,28,36)(H,30,35)(H,31,37)/t16-/m1/s1
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PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM286091
PNG
((R)¿N-(1-(4-aminobenzyl)-1H-pyrazol-4-yl)-9-methyl...)
Show SMILES C[C@@H]1CNC(=O)c2cc3ccc(nc3n12)C(=O)Nc1cnn(Cc2ccc(N)cc2)c1 |r|
Show InChI InChI=1S/C27H29N7O4/c1-16-12-28-25(36)22-11-18-7-10-21(32-23(18)34(16)22)24(35)30-20-13-29-33(15-20)14-17-5-8-19(9-6-17)31-26(37)38-27(2,3)4/h5-11,13,15-16H,12,14H2,1-4H3,(H,28,36)(H,30,35)(H,31,37)/t16-/m1/s1
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PHOENIX MOLECULAR DESIGN

US Patent


Assay Description
Radioisotope assays (SignalChem) were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radio...


US Patent US9771366 (2017)


BindingDB Entry DOI: 10.7270/Q2862JK5
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM286091
PNG
((R)¿N-(1-(4-aminobenzyl)-1H-pyrazol-4-yl)-9-methyl...)
Show SMILES C[C@@H]1CNC(=O)c2cc3ccc(nc3n12)C(=O)Nc1cnn(Cc2ccc(N)cc2)c1 |r|
Show InChI InChI=1S/C27H29N7O4/c1-16-12-28-25(36)22-11-18-7-10-21(32-23(18)34(16)22)24(35)30-20-13-29-33(15-20)14-17-5-8-19(9-6-17)31-26(37)38-27(2,3)4/h5-11,13,15-16H,12,14H2,1-4H3,(H,28,36)(H,30,35)(H,31,37)/t16-/m1/s1
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PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM286089
PNG
((R)¿N-(1-(3-aminobenzyl)-1H-pyrazol-4-yl)-9-methyl...)
Show SMILES C[C@@H]1CNC(=O)c2cc3ccc(nc3n12)C(=O)Nc1cnn(Cc2cccc(N)c2)c1 |r|
Show InChI InChI=1S/C27H29N7O4/c1-16-12-28-25(36)22-11-18-8-9-21(32-23(18)34(16)22)24(35)30-20-13-29-33(15-20)14-17-6-5-7-19(10-17)31-26(37)38-27(2,3)4/h5-11,13,15-16H,12,14H2,1-4H3,(H,28,36)(H,30,35)(H,31,37)/t16-/m1/s1
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n/an/a 23n/an/an/an/an/an/a



PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-1


(Homo sapiens (Human))
BDBM458758
PNG
((R)-1-benzyl-N-(9-methyl-6-oxo-6,7,8,9-tetrahydrop...)
Show SMILES C[C@@H]1CNC(=O)c2cc3ccc(NC(=O)c4cnn(Cc5ccccc5)c4)nc3n12 |r|
Show InChI InChI=1S/C22H20N6O2/c1-14-10-23-22(30)18-9-16-7-8-19(25-20(16)28(14)18)26-21(29)17-11-24-27(13-17)12-15-5-3-2-4-6-15/h2-9,11,13-14H,10,12H2,1H3,(H,23,30)(H,25,26,29)/t14-/m1/s1
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n/an/a 23.6n/an/an/an/an/an/a



PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-1


(Homo sapiens (Human))
BDBM342166
PNG
((R)-1-benzyl-N-(9-methyl-6-oxo-6,7,8,9-tetrahydrop...)
Show SMILES C[C@@H]1CNC(=O)c2cc3cc(NC(=O)c4cnn(Cc5ccccc5)c4)ccc3n12 |r|
Show InChI InChI=1S/C23H21N5O2/c1-15-11-24-23(30)21-10-17-9-19(7-8-20(17)28(15)21)26-22(29)18-12-25-27(14-18)13-16-5-3-2-4-6-16/h2-10,12,14-15H,11,13H2,1H3,(H,24,30)(H,26,29)/t15-/m1/s1
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PHOENIX MOLECULAR DESIGN

US Patent


Assay Description
Radioisotope assays (SignalChem) were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radio...


US Patent US9771366 (2017)


BindingDB Entry DOI: 10.7270/Q2862JK5
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM458758
PNG
((R)-1-benzyl-N-(9-methyl-6-oxo-6,7,8,9-tetrahydrop...)
Show SMILES C[C@@H]1CNC(=O)c2cc3ccc(NC(=O)c4cnn(Cc5ccccc5)c4)nc3n12 |r|
Show InChI InChI=1S/C22H20N6O2/c1-14-10-23-22(30)18-9-16-7-8-19(25-20(16)28(14)18)26-21(29)17-11-24-27(13-17)12-15-5-3-2-4-6-15/h2-9,11,13-14H,10,12H2,1H3,(H,23,30)(H,25,26,29)/t14-/m1/s1
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PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM286092
PNG
((R)-1-(3-aminobenzyl)-N-(9-methyl-6-oxo-6,7,8,9-te...)
Show SMILES C[C@@H]1CNC(=O)c2cc3ccc(NC(=O)c4cnn(Cc5cccc(N)c5)c4)nc3n12 |r|
Show InChI InChI=1S/C27H29N7O4/c1-16-12-28-25(36)21-11-18-8-9-22(31-23(18)34(16)21)32-24(35)19-13-29-33(15-19)14-17-6-5-7-20(10-17)30-26(37)38-27(2,3)4/h5-11,13,15-16H,12,14H2,1-4H3,(H,28,36)(H,30,37)(H,31,32,35)/t16-/m1/s1
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n/an/a 123n/an/an/an/an/an/a



PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM286093
PNG
((R)-9-methyl-N-(1-((1-methylpiperidin-4-yl)methyl)...)
Show SMILES C[C@@H]1CNC(=O)c2cc3ccc(nc3n12)C(=O)Nc1cnn(CC2CCN(C)CC2)c1 |r|
Show InChI InChI=1S/C22H27N7O2/c1-14-10-23-22(31)19-9-16-3-4-18(26-20(16)29(14)19)21(30)25-17-11-24-28(13-17)12-15-5-7-27(2)8-6-15/h3-4,9,11,13-15H,5-8,10,12H2,1-2H3,(H,23,31)(H,25,30)/t14-/m1/s1
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n/an/a 124n/an/an/an/an/an/a



PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM286087
PNG
(1-benzyl-N-(2-methyl-2,3,4,5-tetrahydro-1H-pyrido[...)
Show SMILES CN1CCc2[nH]c3ccc(NC(=O)c4cnn(Cc5ccccc5)c4)cc3c2C1
Show InChI InChI=1S/C23H23N5O/c1-27-10-9-22-20(15-27)19-11-18(7-8-21(19)26-22)25-23(29)17-12-24-28(14-17)13-16-5-3-2-4-6-16/h2-8,11-12,14,26H,9-10,13,15H2,1H3,(H,25,29)
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n/an/a>1.00E+3n/an/an/an/an/an/a



PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
The assay was initiated by the addition of 33P-ATP and the reaction mixture incubated at 30° C. for 15 minutes. After the incubation period, the assa...


US Patent US10081632 (2018)


BindingDB Entry DOI: 10.7270/Q2VT1V45
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM342161
PNG
(1-benzyl-N-(3-(piperazin-1-ylmethyl)benzofuran-6-y...)
Show SMILES O=C(Nc1ccc2c(CN3CCNCC3)csc2c1)c1cnn(Cc2ccccc2)c1
Show InChI InChI=1S/C24H25N5OS/c30-24(19-13-26-29(16-19)14-18-4-2-1-3-5-18)27-21-6-7-22-20(17-31-23(22)12-21)15-28-10-8-25-9-11-28/h1-7,12-13,16-17,25H,8-11,14-15H2,(H,27,30)
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PHOENIX MOLECULAR DESIGN

US Patent


Assay Description
Radioisotope assays (SignalChem) were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radio...


US Patent US9771366 (2017)


BindingDB Entry DOI: 10.7270/Q2862JK5
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM286085
PNG
(1-benzyl-N-(1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a...)
Show SMILES O=C(Nc1ccc2cc3C(=O)NCCn3c2c1)c1cnn(Cc2ccccc2)c1
Show InChI InChI=1S/C22H19N5O2/c28-21(17-12-24-26(14-17)13-15-4-2-1-3-5-15)25-18-7-6-16-10-20-22(29)23-8-9-27(20)19(16)11-18/h1-7,10-12,14H,8-9,13H2,(H,23,29)(H,25,28)
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PHOENIX MOLECULAR DESIGN

US Patent


Assay Description
Radioisotope assays (SignalChem) were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radio...


US Patent US9771366 (2017)


BindingDB Entry DOI: 10.7270/Q2862JK5
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM286086
PNG
(1-benzyl-N-(2-methyl-1,2,3,4-tetrahydrobenzofuro[3...)
Show SMILES CN1CCc2oc3ccc(NC(=O)c4cnn(Cc5ccccc5)c4)cc3c2C1
Show InChI InChI=1S/C23H22N4O2/c1-26-10-9-22-20(15-26)19-11-18(7-8-21(19)29-22)25-23(28)17-12-24-27(14-17)13-16-5-3-2-4-6-16/h2-8,11-12,14H,9-10,13,15H2,1H3,(H,25,28)
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PHOENIX MOLECULAR DESIGN

US Patent


Assay Description
Radioisotope assays (SignalChem) were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radio...


US Patent US9771366 (2017)


BindingDB Entry DOI: 10.7270/Q2862JK5
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM286087
PNG
(1-benzyl-N-(2-methyl-2,3,4,5-tetrahydro-1H-pyrido[...)
Show SMILES CN1CCc2[nH]c3ccc(NC(=O)c4cnn(Cc5ccccc5)c4)cc3c2C1
Show InChI InChI=1S/C23H23N5O/c1-27-10-9-22-20(15-27)19-11-18(7-8-21(19)26-22)25-23(29)17-12-24-28(14-17)13-16-5-3-2-4-6-16/h2-8,11-12,14,26H,9-10,13,15H2,1H3,(H,25,29)
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PHOENIX MOLECULAR DESIGN

US Patent


Assay Description
Radioisotope assays (SignalChem) were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radio...


US Patent US9771366 (2017)


BindingDB Entry DOI: 10.7270/Q2862JK5
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM286083
PNG
(1-benzyl-N-(3-(piperazin-1-ylmethyl)benzofuran-6-y...)
Show SMILES O=C(Nc1ccc2c(CN3CCNCC3)coc2c1)c1cnn(Cc2ccccc2)c1
Show InChI InChI=1S/C29H33N5O4/c1-29(2,3)38-28(36)33-13-11-32(12-14-33)18-23-20-37-26-15-24(9-10-25(23)26)31-27(35)22-16-30-34(19-22)17-21-7-5-4-6-8-21/h4-10,15-16,19-20H,11-14,17-18H2,1-3H3,(H,31,35)
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PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM286085
PNG
(1-benzyl-N-(1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a...)
Show SMILES O=C(Nc1ccc2cc3C(=O)NCCn3c2c1)c1cnn(Cc2ccccc2)c1
Show InChI InChI=1S/C22H19N5O2/c28-21(17-12-24-26(14-17)13-15-4-2-1-3-5-15)25-18-7-6-16-10-20-22(29)23-8-9-27(20)19(16)11-18/h1-7,10-12,14H,8-9,13H2,(H,23,29)(H,25,28)
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PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM286086
PNG
(1-benzyl-N-(2-methyl-1,2,3,4-tetrahydrobenzofuro[3...)
Show SMILES CN1CCc2oc3ccc(NC(=O)c4cnn(Cc5ccccc5)c4)cc3c2C1
Show InChI InChI=1S/C23H22N4O2/c1-26-10-9-22-20(15-26)19-11-18(7-8-21(19)29-22)25-23(28)17-12-24-27(14-17)13-16-5-3-2-4-6-16/h2-8,11-12,14H,9-10,13,15H2,1H3,(H,25,28)
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PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM286087
PNG
(1-benzyl-N-(2-methyl-2,3,4,5-tetrahydro-1H-pyrido[...)
Show SMILES CN1CCc2[nH]c3ccc(NC(=O)c4cnn(Cc5ccccc5)c4)cc3c2C1
Show InChI InChI=1S/C23H23N5O/c1-27-10-9-22-20(15-27)19-11-18(7-8-21(19)26-22)25-23(29)17-12-24-28(14-17)13-16-5-3-2-4-6-16/h2-8,11-12,14,26H,9-10,13,15H2,1H3,(H,25,29)
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PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM286086
PNG
(1-benzyl-N-(2-methyl-1,2,3,4-tetrahydrobenzofuro[3...)
Show SMILES CN1CCc2oc3ccc(NC(=O)c4cnn(Cc5ccccc5)c4)cc3c2C1
Show InChI InChI=1S/C23H22N4O2/c1-26-10-9-22-20(15-26)19-11-18(7-8-21(19)29-22)25-23(28)17-12-24-27(14-17)13-16-5-3-2-4-6-16/h2-8,11-12,14H,9-10,13,15H2,1H3,(H,25,28)
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PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
The assay was initiated by the addition of 33P-ATP and the reaction mixture incubated at 30° C. for 15 minutes. After the incubation period, the assa...


US Patent US10081632 (2018)


BindingDB Entry DOI: 10.7270/Q2VT1V45
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM286083
PNG
(1-benzyl-N-(3-(piperazin-1-ylmethyl)benzofuran-6-y...)
Show SMILES O=C(Nc1ccc2c(CN3CCNCC3)coc2c1)c1cnn(Cc2ccccc2)c1
Show InChI InChI=1S/C29H33N5O4/c1-29(2,3)38-28(36)33-13-11-32(12-14-33)18-23-20-37-26-15-24(9-10-25(23)26)31-27(35)22-16-30-34(19-22)17-21-7-5-4-6-8-21/h4-10,15-16,19-20H,11-14,17-18H2,1-3H3,(H,31,35)
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PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
The assay was initiated by the addition of 33P-ATP and the reaction mixture incubated at 30° C. for 15 minutes. After the incubation period, the assa...


US Patent US10081632 (2018)


BindingDB Entry DOI: 10.7270/Q2VT1V45
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM286085
PNG
(1-benzyl-N-(1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a...)
Show SMILES O=C(Nc1ccc2cc3C(=O)NCCn3c2c1)c1cnn(Cc2ccccc2)c1
Show InChI InChI=1S/C22H19N5O2/c28-21(17-12-24-26(14-17)13-15-4-2-1-3-5-15)25-18-7-6-16-10-20-22(29)23-8-9-27(20)19(16)11-18/h1-7,10-12,14H,8-9,13H2,(H,23,29)(H,25,28)
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PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
The assay was initiated by the addition of 33P-ATP and the reaction mixture incubated at 30° C. for 15 minutes. After the incubation period, the assa...


US Patent US10081632 (2018)


BindingDB Entry DOI: 10.7270/Q2VT1V45
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM286084
PNG
((R)-1-benzyl-N-(4-methyl-1-oxo-1,2,3,4-tetrahydrop...)
Show SMILES C[C@@H]1CNC(=O)c2cc3ccc(NC(=O)c4cnn(Cc5ccccc5)c4)cc3n12 |r|
Show InChI InChI=1S/C18H23BrN2O4/c1-11(10-20-17(23)25-18(2,3)4)21-14-9-13(19)7-6-12(14)8-15(21)16(22)24-5/h6-9,11H,10H2,1-5H3,(H,20,23)/t11-/m1/s1
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n/an/a 1.38E+3n/an/an/an/an/an/a



PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM286074
PNG
(1-Benzyl-N-(3-(morpholinomethyl)-1H-indol-5-yl)-1H...)
Show SMILES O=C(Nc1ccc2[nH]cc(CN3CCOCC3)c2c1)c1cnn(Cc2ccccc2)c1
Show InChI InChI=1S/C24H25N5O2/c30-24(20-14-26-29(17-20)15-18-4-2-1-3-5-18)27-21-6-7-23-22(12-21)19(13-25-23)16-28-8-10-31-11-9-28/h1-7,12-14,17,25H,8-11,15-16H2,(H,27,30)
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PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
The assay was initiated by the addition of 33P-ATP and the reaction mixture incubated at 30° C. for 15 minutes. After the incubation period, the assa...


US Patent US10081632 (2018)


BindingDB Entry DOI: 10.7270/Q2VT1V45
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-2


(Homo sapiens (Human))
BDBM286082
PNG
(1-benzyl-N-(3-(piperazin-1-ylmethyl)benzofuran-5-y...)
Show SMILES O=C(Nc1ccc2occ(CN3CCNCC3)c2c1)c1cnn(Cc2ccccc2)c1
Show InChI InChI=1S/C29H33N5O4/c1-29(2,3)38-28(36)33-13-11-32(12-14-33)18-23-20-37-26-10-9-24(15-25(23)26)31-27(35)22-16-30-34(19-22)17-21-7-5-4-6-8-21/h4-10,15-16,19-20H,11-14,17-18H2,1-3H3,(H,31,35)
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PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
Radioisotope assays were performed for the evaluation of the kinase target profiling and all assays were performed in a designated radioactive workin...


US Patent US10758530 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SGD
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3


(Homo sapiens (Human))
BDBM286076
PNG
(1-Benzyl-N-(3-((4-methylpiperazin-1-yl)methyl)-1H-...)
Show SMILES CN1CCN(Cc2c[nH]c3ccc(NC(=O)c4cnn(Cc5ccccc5)c4)cc23)CC1
Show InChI InChI=1S/C25H28N6O/c1-29-9-11-30(12-10-29)17-20-14-26-24-8-7-22(13-23(20)24)28-25(32)21-15-27-31(18-21)16-19-5-3-2-4-6-19/h2-8,13-15,18,26H,9-12,16-17H2,1H3,(H,28,32)
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PHOENIX MOLECULAR DESIGNS

US Patent


Assay Description
The assay was initiated by the addition of 33P-ATP and the reaction mixture incubated at 30° C. for 15 minutes. After the incubation period, the assa...


US Patent US10081632 (2018)


BindingDB Entry DOI: 10.7270/Q2VT1V45
More data for this
Ligand-Target Pair
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