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19 similar compounds to monomer 116813

Compile data set for download or QSAR
Wt: 420.4
BDBM116904
Wt: 398.4
BDBM116915
Wt: 427.4
BDBM116771
Wt: 438.4
BDBM116814
Wt: 395.4
BDBM116823
Wt: 384.4
BDBM116843
Wt: 409.4
BDBM116848
Wt: 453.5
BDBM116857
Wt: 409.4
BDBM116868
Wt: 434.4
BDBM116876
Wt: 438.4
BDBM116877
Wt: 385.4
BDBM116889
Wt: 424.4
BDBM116890
Wt: 371.3
BDBM116893
Wt: 293.3
BDBM116470
Displayed 1 to 15 (of 19 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 30 hits for monomerid = 116904,116915,116771,116814,116823,116843,116848,116857,116868,116876,116877,116889,116890,116893,116470   
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
Ribosomal protein S6 kinase (P70S6K)


(Homo sapiens (Human))
BDBM116470
PNG
(US8637532, 151)
Show SMILES NC(=O)c1cccc2c(NCc3ccc(N)cc3)ncnc12
Show InChI InChI=1S/C16H15N5O/c17-11-6-4-10(5-7-11)8-19-16-13-3-1-2-12(15(18)22)14(13)20-9-21-16/h1-7,9H,8,17H2,(H2,18,22)(H,19,20,21)
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n/an/a 210n/an/an/an/a7.525



Merck Patent GmbH

US Patent


Assay Description
P70S6K inhibitor compounds are diluted and plated in 96 well plates. A reaction mixture including the following components is then added to the compo...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM116893
PNG
(US8637532, 619)
Show SMILES NC(=O)c1cccc2c(NCc3cccc(Nc4ncccn4)c3)ncnc12
Show InChI InChI=1S/C20H17N7O/c21-18(28)15-6-2-7-16-17(15)25-12-26-19(16)24-11-13-4-1-5-14(10-13)27-20-22-8-3-9-23-20/h1-10,12H,11H2,(H2,21,28)(H,22,23,27)(H,24,25,26)
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n/an/a 3.30n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase (P70S6K)


(Homo sapiens (Human))
BDBM116843
PNG
(US8637532, 569)
Show SMILES Cc1ccnc(Nc2cccc(CNc3ncnc4c(cccc34)C(N)=O)c2)c1
Show InChI InChI=1S/C22H20N6O/c1-14-8-9-24-19(10-14)28-16-5-2-4-15(11-16)12-25-22-18-7-3-6-17(21(23)29)20(18)26-13-27-22/h2-11,13H,12H2,1H3,(H2,23,29)(H,24,28)(H,25,26,27)
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n/an/a 390n/an/an/an/a7.525



Merck Patent GmbH

US Patent


Assay Description
P70S6K inhibitor compounds are diluted and plated in 96 well plates. A reaction mixture including the following components is then added to the compo...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase (P70S6K)


(Homo sapiens (Human))
BDBM116848
PNG
(US8637532, 574)
Show SMILES NC(=O)c1cccc2c(NCc3cccc(Nc4ccc(CC#N)cn4)c3)ncnc12
Show InChI InChI=1S/C23H19N7O/c24-10-9-15-7-8-20(26-12-15)30-17-4-1-3-16(11-17)13-27-23-19-6-2-5-18(22(25)31)21(19)28-14-29-23/h1-8,11-12,14H,9,13H2,(H2,25,31)(H,26,30)(H,27,28,29)
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n/an/a 280n/an/an/an/a7.525



Merck Patent GmbH

US Patent


Assay Description
P70S6K inhibitor compounds are diluted and plated in 96 well plates. A reaction mixture including the following components is then added to the compo...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase (P70S6K)


(Homo sapiens (Human))
BDBM116868
PNG
(US8637532, 594)
Show SMILES NC(=O)c1cccc2c(NCc3cccc(Nc4cc(CC#N)ccn4)c3)ncnc12
Show InChI InChI=1S/C23H19N7O/c24-9-7-15-8-10-26-20(12-15)30-17-4-1-3-16(11-17)13-27-23-19-6-2-5-18(22(25)31)21(19)28-14-29-23/h1-6,8,10-12,14H,7,13H2,(H2,25,31)(H,26,30)(H,27,28,29)
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n/an/a 660n/an/an/an/a7.525



Merck Patent GmbH

US Patent


Assay Description
P70S6K inhibitor compounds are diluted and plated in 96 well plates. A reaction mixture including the following components is then added to the compo...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase (P70S6K)


(Homo sapiens (Human))
BDBM116890
PNG
(US8637532, 616)
Show SMILES Cc1nc2ccnc(Nc3cccc(CNc4ncnc5c(cccc45)C(N)=O)c3)c2[nH]1
Show InChI InChI=1S/C23H20N8O/c1-13-29-18-8-9-25-23(20(18)30-13)31-15-5-2-4-14(10-15)11-26-22-17-7-3-6-16(21(24)32)19(17)27-12-28-22/h2-10,12H,11H2,1H3,(H2,24,32)(H,25,31)(H,29,30)(H,26,27,28)
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n/an/a 130n/an/an/an/a7.525



Merck Patent GmbH

US Patent


Assay Description
P70S6K inhibitor compounds are diluted and plated in 96 well plates. A reaction mixture including the following components is then added to the compo...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase (P70S6K)


(Homo sapiens (Human))
BDBM116893
PNG
(US8637532, 619)
Show SMILES NC(=O)c1cccc2c(NCc3cccc(Nc4ncccn4)c3)ncnc12
Show InChI InChI=1S/C20H17N7O/c21-18(28)15-6-2-7-16-17(15)25-12-26-19(16)24-11-13-4-1-5-14(10-13)27-20-22-8-3-9-23-20/h1-10,12H,11H2,(H2,21,28)(H,22,23,27)(H,24,25,26)
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n/an/a 500n/an/an/an/a7.525



Merck Patent GmbH

US Patent


Assay Description
P70S6K inhibitor compounds are diluted and plated in 96 well plates. A reaction mixture including the following components is then added to the compo...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase (P70S6K)


(Homo sapiens (Human))
BDBM116904
PNG
(US8637532, 630)
Show SMILES NC(=O)c1cccc2c(NCc3cccc(Nc4ccc5ccccc5n4)c3)ncnc12
Show InChI InChI=1S/C25H20N6O/c26-24(32)19-8-4-9-20-23(19)28-15-29-25(20)27-14-16-5-3-7-18(13-16)30-22-12-11-17-6-1-2-10-21(17)31-22/h1-13,15H,14H2,(H2,26,32)(H,30,31)(H,27,28,29)
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n/an/a 1.00E+3n/an/an/an/a7.525



Merck Patent GmbH

US Patent


Assay Description
P70S6K inhibitor compounds are diluted and plated in 96 well plates. A reaction mixture including the following components is then added to the compo...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM116470
PNG
(US8637532, 151)
Show SMILES NC(=O)c1cccc2c(NCc3ccc(N)cc3)ncnc12
Show InChI InChI=1S/C16H15N5O/c17-11-6-4-10(5-7-11)8-19-16-13-3-1-2-12(15(18)22)14(13)20-9-21-16/h1-7,9H,8,17H2,(H2,18,22)(H,19,20,21)
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n/an/a 9.30E+3n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM116771
PNG
(US8637532, 488)
Show SMILES CNc1ccc(cn1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
Show InChI InChI=1S/C23H21N7O2/c1-25-19-9-8-15(12-26-19)23(32)30-16-5-2-4-14(10-16)11-27-22-18-7-3-6-17(21(24)31)20(18)28-13-29-22/h2-10,12-13H,11H2,1H3,(H2,24,31)(H,25,26)(H,30,32)(H,27,28,29)
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n/an/a 0.690n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM116814
PNG
(US8637532, 540)
Show SMILES NC(=O)c1cccc2c(NCc3cccc(Nc4cc(ccn4)C(F)(F)F)c3)ncnc12
Show InChI InChI=1S/C22H17F3N6O/c23-22(24,25)14-7-8-27-18(10-14)31-15-4-1-3-13(9-15)11-28-21-17-6-2-5-16(20(26)32)19(17)29-12-30-21/h1-10,12H,11H2,(H2,26,32)(H,27,31)(H,28,29,30)
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n/an/a 0.150n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM116823
PNG
(US8637532, 549)
Show SMILES NC(=O)c1cccc2c(NCc3cccc(Nc4cc(ccn4)C#N)c3)ncnc12
Show InChI InChI=1S/C22H17N7O/c23-11-14-7-8-25-19(10-14)29-16-4-1-3-15(9-16)12-26-22-18-6-2-5-17(21(24)30)20(18)27-13-28-22/h1-10,13H,12H2,(H2,24,30)(H,25,29)(H,26,27,28)
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n/an/a 0.220n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM116843
PNG
(US8637532, 569)
Show SMILES Cc1ccnc(Nc2cccc(CNc3ncnc4c(cccc34)C(N)=O)c2)c1
Show InChI InChI=1S/C22H20N6O/c1-14-8-9-24-19(10-14)28-16-5-2-4-15(11-16)12-25-22-18-7-3-6-17(21(23)29)20(18)26-13-27-22/h2-11,13H,12H2,1H3,(H2,23,29)(H,24,28)(H,25,26,27)
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n/an/a 0.850n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM116848
PNG
(US8637532, 574)
Show SMILES NC(=O)c1cccc2c(NCc3cccc(Nc4ccc(CC#N)cn4)c3)ncnc12
Show InChI InChI=1S/C23H19N7O/c24-10-9-15-7-8-20(26-12-15)30-17-4-1-3-16(11-17)13-27-23-19-6-2-5-18(22(25)31)21(19)28-14-29-23/h1-8,11-12,14H,9,13H2,(H2,25,31)(H,26,30)(H,27,28,29)
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n/an/a 1n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM116857
PNG
(US8637532, 583)
Show SMILES NC(=O)c1cccc2c(NCc3cccc(Nc4ccc(cn4)C4CCNCC4)c3)ncnc12
Show InChI InChI=1S/C26H27N7O/c27-25(34)21-5-2-6-22-24(21)31-16-32-26(22)30-14-17-3-1-4-20(13-17)33-23-8-7-19(15-29-23)18-9-11-28-12-10-18/h1-8,13,15-16,18,28H,9-12,14H2,(H2,27,34)(H,29,33)(H,30,31,32)
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n/an/a 1.5n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM116868
PNG
(US8637532, 594)
Show SMILES NC(=O)c1cccc2c(NCc3cccc(Nc4cc(CC#N)ccn4)c3)ncnc12
Show InChI InChI=1S/C23H19N7O/c24-9-7-15-8-10-26-20(12-15)30-17-4-1-3-16(11-17)13-27-23-19-6-2-5-18(22(25)31)21(19)28-14-29-23/h1-6,8,10-12,14H,7,13H2,(H2,25,31)(H,26,30)(H,27,28,29)
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n/an/a 2.30n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM116876
PNG
(US8637532, 602)
Show SMILES Cc1ccc2ccnc(Nc3cccc(CNc4ncnc5c(cccc45)C(N)=O)c3)c2c1
Show InChI InChI=1S/C26H22N6O/c1-16-8-9-18-10-11-28-26(22(18)12-16)32-19-5-2-4-17(13-19)14-29-25-21-7-3-6-20(24(27)33)23(21)30-15-31-25/h2-13,15H,14H2,1H3,(H2,27,33)(H,28,32)(H,29,30,31)
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n/an/a 3.5n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM116877
PNG
(US8637532, 603)
Show SMILES NC(=O)c1cccc2c(NCc3cccc(Nc4ccc(cn4)C(F)(F)F)c3)ncnc12
Show InChI InChI=1S/C22H17F3N6O/c23-22(24,25)14-7-8-18(27-11-14)31-15-4-1-3-13(9-15)10-28-21-17-6-2-5-16(20(26)32)19(17)29-12-30-21/h1-9,11-12H,10H2,(H2,26,32)(H,27,31)(H,28,29,30)
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n/an/a 3.60n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM116889
PNG
(US8637532, 615)
Show SMILES NC(=O)c1cccc2c(NCc3cccc(Nc4ccc(N)cn4)c3)ncnc12
Show InChI InChI=1S/C21H19N7O/c22-14-7-8-18(24-11-14)28-15-4-1-3-13(9-15)10-25-21-17-6-2-5-16(20(23)29)19(17)26-12-27-21/h1-9,11-12H,10,22H2,(H2,23,29)(H,24,28)(H,25,26,27)
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n/an/a 7.60n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM116890
PNG
(US8637532, 616)
Show SMILES Cc1nc2ccnc(Nc3cccc(CNc4ncnc5c(cccc45)C(N)=O)c3)c2[nH]1
Show InChI InChI=1S/C23H20N8O/c1-13-29-18-8-9-25-23(20(18)30-13)31-15-5-2-4-14(10-15)11-26-22-17-7-3-6-16(21(24)32)19(17)27-12-28-22/h2-10,12H,11H2,1H3,(H2,24,32)(H,25,31)(H,29,30)(H,26,27,28)
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n/an/a 8.60n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM116893
PNG
(US8637532, 619)
Show SMILES NC(=O)c1cccc2c(NCc3cccc(Nc4ncccn4)c3)ncnc12
Show InChI InChI=1S/C20H17N7O/c21-18(28)15-6-2-7-16-17(15)25-12-26-19(16)24-11-13-4-1-5-14(10-13)27-20-22-8-3-9-23-20/h1-10,12H,11H2,(H2,21,28)(H,22,23,27)(H,24,25,26)
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n/an/a 11n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM116904
PNG
(US8637532, 630)
Show SMILES NC(=O)c1cccc2c(NCc3cccc(Nc4ccc5ccccc5n4)c3)ncnc12
Show InChI InChI=1S/C25H20N6O/c26-24(32)19-8-4-9-20-23(19)28-15-29-25(20)27-14-16-5-3-7-18(13-16)30-22-12-11-17-6-1-2-10-21(17)31-22/h1-13,15H,14H2,(H2,26,32)(H,30,31)(H,27,28,29)
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n/an/a 34n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM116915
PNG
(US8637532, 642)
Show SMILES CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(Nc2cc(C)ccn2)c1
Show InChI InChI=1S/C23H22N6O/c1-14-9-10-25-20(11-14)29-17-6-3-5-16(12-17)15(2)28-23-19-8-4-7-18(22(24)30)21(19)26-13-27-23/h3-13,15H,1-2H3,(H2,24,30)(H,25,29)(H,26,27,28)
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n/an/a 0.390n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM116771
PNG
(US8637532, 488)
Show SMILES CNc1ccc(cn1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
Show InChI InChI=1S/C23H21N7O2/c1-25-19-9-8-15(12-26-19)23(32)30-16-5-2-4-14(10-16)11-27-22-18-7-3-6-17(21(24)31)20(18)28-13-29-22/h2-10,12-13H,11H2,1H3,(H2,24,31)(H,25,26)(H,30,32)(H,27,28,29)
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n/an/a 0.260n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM116823
PNG
(US8637532, 549)
Show SMILES NC(=O)c1cccc2c(NCc3cccc(Nc4cc(ccn4)C#N)c3)ncnc12
Show InChI InChI=1S/C22H17N7O/c23-11-14-7-8-25-19(10-14)29-16-4-1-3-15(9-16)12-26-22-18-6-2-5-17(21(24)30)20(18)27-13-28-22/h1-10,13H,12H2,(H2,24,30)(H,25,29)(H,26,27,28)
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n/an/a 0.0600n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM116843
PNG
(US8637532, 569)
Show SMILES Cc1ccnc(Nc2cccc(CNc3ncnc4c(cccc34)C(N)=O)c2)c1
Show InChI InChI=1S/C22H20N6O/c1-14-8-9-24-19(10-14)28-16-5-2-4-15(11-16)12-25-22-18-7-3-6-17(21(23)29)20(18)26-13-27-22/h2-11,13H,12H2,1H3,(H2,23,29)(H,24,28)(H,25,26,27)
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n/an/a 0.390n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM116848
PNG
(US8637532, 574)
Show SMILES NC(=O)c1cccc2c(NCc3cccc(Nc4ccc(CC#N)cn4)c3)ncnc12
Show InChI InChI=1S/C23H19N7O/c24-10-9-15-7-8-20(26-12-15)30-17-4-1-3-16(11-17)13-27-23-19-6-2-5-18(22(25)31)21(19)28-14-29-23/h1-8,11-12,14H,9,13H2,(H2,25,31)(H,26,30)(H,27,28,29)
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n/an/a 0.760n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM116868
PNG
(US8637532, 594)
Show SMILES NC(=O)c1cccc2c(NCc3cccc(Nc4cc(CC#N)ccn4)c3)ncnc12
Show InChI InChI=1S/C23H19N7O/c24-9-7-15-8-10-26-20(12-15)30-17-4-1-3-16(11-17)13-27-23-19-6-2-5-18(22(25)31)21(19)28-14-29-23/h1-6,8,10-12,14H,7,13H2,(H2,25,31)(H,26,30)(H,27,28,29)
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n/an/a 0.180n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM116877
PNG
(US8637532, 603)
Show SMILES NC(=O)c1cccc2c(NCc3cccc(Nc4ccc(cn4)C(F)(F)F)c3)ncnc12
Show InChI InChI=1S/C22H17F3N6O/c23-22(24,25)14-7-8-18(27-11-14)31-15-4-1-3-13(9-15)10-28-21-17-6-2-5-16(20(26)32)19(17)29-12-30-21/h1-9,11-12H,10H2,(H2,26,32)(H,27,31)(H,28,29,30)
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n/an/a 15n/an/an/an/an/an/a



Merck Patent GmbH

US Patent


Assay Description
The Aurora assays described here are performed on two Caliper Life Sciences systems: the LC3000 and the Desktop Profiler. These provide data on enzym...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair
Ribosomal protein S6 kinase (P70S6K)


(Homo sapiens (Human))
BDBM116771
PNG
(US8637532, 488)
Show SMILES CNc1ccc(cn1)C(=O)Nc1cccc(CNc2ncnc3c(cccc23)C(N)=O)c1
Show InChI InChI=1S/C23H21N7O2/c1-25-19-9-8-15(12-26-19)23(32)30-16-5-2-4-14(10-16)11-27-22-18-7-3-6-17(21(24)31)20(18)28-13-29-22/h2-10,12-13H,11H2,1H3,(H2,24,31)(H,25,26)(H,30,32)(H,27,28,29)
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n/an/a 66n/an/an/an/a7.525



Merck Patent GmbH

US Patent


Assay Description
P70S6K inhibitor compounds are diluted and plated in 96 well plates. A reaction mixture including the following components is then added to the compo...


US Patent US8637532 (2014)


BindingDB Entry DOI: 10.7270/Q21G0JZX
More data for this
Ligand-Target Pair