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17 similar compounds to monomer 116321

Compile data set for download or QSAR
Wt: 341.7
BDBM116323
Wt: 321.3
BDBM116324
Wt: 307.3
BDBM116384
Wt: 347.4
BDBM116693
Wt: 325.3
BDBM116435
Wt: 347.1
BDBM116448
Wt: 292.3
BDBM116451
Wt: 292.3
BDBM116490
Wt: 390.2
BDBM116506
Wt: 355.8
BDBM116515
Wt: 404.2
BDBM116519
Wt: 369.8
BDBM116531
Wt: 335.4
BDBM116554
Wt: 335.4
BDBM116587
Wt: 363.4
BDBM116641
Displayed 1 to 15 (of 17 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 32 hits for monomerid = 116323,116324,116384,116693,116435,116448,116451,116490,116506,116515,116519,116531,116554,116587,116641   
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))
BDBM116324
PNG
(US8637532, 5)
Show SMILES Cc1ccc(cc1)C(CN)Nc1ncnc2c(cccc12)C(N)=O
Show InChI InChI=1S/C18H19N5O/c1-11-5-7-12(8-6-11)15(9-19)23-18-14-4-2-3-13(17(20)24)16(14)21-10-22-18/h2-8,10,15H,9,19H2,1H3,(H2,20,24)(H,21,22,23)
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n/an/a 0.600n/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))
BDBM116554
PNG
(US8637532, 245)
Show SMILES CN(C)C[C@@H](Nc1ncnc2c(cccc12)C(N)=O)c1ccccc1
Show InChI InChI=1S/C19H21N5O/c1-24(2)11-16(13-7-4-3-5-8-13)23-19-15-10-6-9-14(18(20)25)17(15)21-12-22-19/h3-10,12,16H,11H2,1-2H3,(H2,20,25)(H,21,22,23)/t16-/m1/s1
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n/an/a 2.40n/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))
BDBM116435
PNG
(US8637532, 116)
Show SMILES NCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(F)c1
Show InChI InChI=1S/C17H16FN5O/c18-11-4-1-3-10(7-11)14(8-19)23-17-13-6-2-5-12(16(20)24)15(13)21-9-22-17/h1-7,9,14H,8,19H2,(H2,20,24)(H,21,22,23)
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n/an/a 0.5n/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))
BDBM116448
PNG
(US8637532, 129)
Show SMILES NC(=O)c1cccc2c(NCc3ccc(Cl)c(Cl)c3)ncnc12
Show InChI InChI=1S/C16H12Cl2N4O/c17-12-5-4-9(6-13(12)18)7-20-16-11-3-1-2-10(15(19)23)14(11)21-8-22-16/h1-6,8H,7H2,(H2,19,23)(H,20,21,22)
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n/an/a 1.60n/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))
BDBM116451
PNG
(US8637532, 132)
Show SMILES C[C@H](Nc1ncnc2c(cccc12)C(N)=O)c1ccccc1
Show InChI InChI=1S/C17H16N4O/c1-11(12-6-3-2-4-7-12)21-17-14-9-5-8-13(16(18)22)15(14)19-10-20-17/h2-11H,1H3,(H2,18,22)(H,19,20,21)/t11-/m0/s1
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n/an/a 2.84E+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
Ribosomal protein S6 kinase (P70S6K)


(Homo sapiens (Human))
BDBM116490
PNG
(US8637532, 171)
Show SMILES C[C@@H](Nc1ncnc2c(cccc12)C(N)=O)c1ccccc1
Show InChI InChI=1S/C17H16N4O/c1-11(12-6-3-2-4-7-12)21-17-14-9-5-8-13(16(18)22)15(14)19-10-20-17/h2-11H,1H3,(H2,18,22)(H,19,20,21)/t11-/m1/s1
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n/an/a 85n/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))
BDBM116506
PNG
(US8637532, 187)
Show SMILES CNCC(Nc1ncnc2c(cccc12)C(N)=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C18H17Cl2N5O/c1-22-8-15(10-5-6-13(19)14(20)7-10)25-18-12-4-2-3-11(17(21)26)16(12)23-9-24-18/h2-7,9,15,22H,8H2,1H3,(H2,21,26)(H,23,24,25)
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n/an/a 0.360n/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))
BDBM116515
PNG
(US8637532, 199)
Show SMILES CNCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(Cl)c1
Show InChI InChI=1S/C18H18ClN5O/c1-21-9-15(11-4-2-5-12(19)8-11)24-18-14-7-3-6-13(17(20)25)16(14)22-10-23-18/h2-8,10,15,21H,9H2,1H3,(H2,20,25)(H,22,23,24)
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n/an/a 0.660n/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))
BDBM116519
PNG
(US8637532, 205)
Show SMILES CN(C)CC(Nc1ncnc2c(cccc12)C(N)=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C19H19Cl2N5O/c1-26(2)9-16(11-6-7-14(20)15(21)8-11)25-19-13-5-3-4-12(18(22)27)17(13)23-10-24-19/h3-8,10,16H,9H2,1-2H3,(H2,22,27)(H,23,24,25)
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n/an/a 0.790n/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))
BDBM116531
PNG
(US8637532, 217)
Show SMILES CN(C)CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(Cl)c1
Show InChI InChI=1S/C19H20ClN5O/c1-25(2)10-16(12-5-3-6-13(20)9-12)24-19-15-8-4-7-14(18(21)26)17(15)22-11-23-19/h3-9,11,16H,10H2,1-2H3,(H2,21,26)(H,22,23,24)
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n/an/a 1.10n/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))
BDBM116554
PNG
(US8637532, 245)
Show SMILES CN(C)C[C@@H](Nc1ncnc2c(cccc12)C(N)=O)c1ccccc1
Show InChI InChI=1S/C19H21N5O/c1-24(2)11-16(13-7-4-3-5-8-13)23-19-15-10-6-9-14(18(20)25)17(15)21-12-22-19/h3-10,12,16H,11H2,1-2H3,(H2,20,25)(H,21,22,23)/t16-/m1/s1
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n/an/a 3.5n/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))
BDBM116587
PNG
(US8637532, 279)
Show SMILES CCNC[C@@H](Nc1ncnc2c(cccc12)C(N)=O)c1ccccc1
Show InChI InChI=1S/C19H21N5O/c1-2-21-11-16(13-7-4-3-5-8-13)24-19-15-10-6-9-14(18(20)25)17(15)22-12-23-19/h3-10,12,16,21H,2,11H2,1H3,(H2,20,25)(H,22,23,24)/t16-/m1/s1
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n/an/a 7.40n/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))
BDBM116641
PNG
(US8637532, 340)
Show SMILES CC(C)N(C)C[C@@H](Nc1ncnc2c(cccc12)C(N)=O)c1ccccc1
Show InChI InChI=1S/C21H25N5O/c1-14(2)26(3)12-18(15-8-5-4-6-9-15)25-21-17-11-7-10-16(20(22)27)19(17)23-13-24-21/h4-11,13-14,18H,12H2,1-3H3,(H2,22,27)(H,23,24,25)/t18-/m1/s1
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n/an/a 18n/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))
BDBM116693
PNG
(US8637532, 397)
Show SMILES NC(=O)c1cccc2c(N[C@H](CNC3CC3)c3ccccc3)ncnc12
Show InChI InChI=1S/C20H21N5O/c21-19(26)15-7-4-8-16-18(15)23-12-24-20(16)25-17(11-22-14-9-10-14)13-5-2-1-3-6-13/h1-8,12,14,17,22H,9-11H2,(H2,21,26)(H,23,24,25)/t17-/m1/s1
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n/an/a 28n/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))
BDBM116323
PNG
(US8637532, 4)
Show SMILES NCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(Cl)c1
Show InChI InChI=1S/C17H16ClN5O/c18-11-4-1-3-10(7-11)14(8-19)23-17-13-6-2-5-12(16(20)24)15(13)21-9-22-17/h1-7,9,14H,8,19H2,(H2,20,24)(H,21,22,23)
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n/an/a 4.90E+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))
BDBM116324
PNG
(US8637532, 5)
Show SMILES Cc1ccc(cc1)C(CN)Nc1ncnc2c(cccc12)C(N)=O
Show InChI InChI=1S/C18H19N5O/c1-11-5-7-12(8-6-11)15(9-19)23-18-14-4-2-3-13(17(20)24)16(14)21-10-22-18/h2-8,10,15H,9,19H2,1H3,(H2,20,24)(H,21,22,23)
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n/an/a 660n/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))
BDBM116384
PNG
(US8637532, 65)
Show SMILES NC[C@@H](Nc1ncnc2c(cccc12)C(N)=O)c1ccccc1
Show InChI InChI=1S/C17H17N5O/c18-9-14(11-5-2-1-3-6-11)22-17-13-8-4-7-12(16(19)23)15(13)20-10-21-17/h1-8,10,14H,9,18H2,(H2,19,23)(H,20,21,22)/t14-/m1/s1
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n/an/a 310n/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))
BDBM116435
PNG
(US8637532, 116)
Show SMILES NCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(F)c1
Show InChI InChI=1S/C17H16FN5O/c18-11-4-1-3-10(7-11)14(8-19)23-17-13-6-2-5-12(16(20)24)15(13)21-9-22-17/h1-7,9,14H,8,19H2,(H2,20,24)(H,21,22,23)
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n/an/a 280n/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))
BDBM116448
PNG
(US8637532, 129)
Show SMILES NC(=O)c1cccc2c(NCc3ccc(Cl)c(Cl)c3)ncnc12
Show InChI InChI=1S/C16H12Cl2N4O/c17-12-5-4-9(6-13(12)18)7-20-16-11-3-1-2-10(15(19)23)14(11)21-8-22-16/h1-6,8H,7H2,(H2,19,23)(H,20,21,22)
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n/an/a 130n/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))
BDBM116451
PNG
(US8637532, 132)
Show SMILES C[C@H](Nc1ncnc2c(cccc12)C(N)=O)c1ccccc1
Show InChI InChI=1S/C17H16N4O/c1-11(12-6-3-2-4-7-12)21-17-14-9-5-8-13(16(18)22)15(14)19-10-20-17/h2-11H,1H3,(H2,18,22)(H,19,20,21)/t11-/m0/s1
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n/an/a 410n/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))
BDBM116506
PNG
(US8637532, 187)
Show SMILES CNCC(Nc1ncnc2c(cccc12)C(N)=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C18H17Cl2N5O/c1-22-8-15(10-5-6-13(19)14(20)7-10)25-18-12-4-2-3-11(17(21)26)16(12)23-9-24-18/h2-7,9,15,22H,8H2,1H3,(H2,21,26)(H,23,24,25)
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n/an/a 540n/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))
BDBM116515
PNG
(US8637532, 199)
Show SMILES CNCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(Cl)c1
Show InChI InChI=1S/C18H18ClN5O/c1-21-9-15(11-4-2-5-12(19)8-11)24-18-14-7-3-6-13(17(20)25)16(14)22-10-23-18/h2-8,10,15,21H,9H2,1H3,(H2,20,25)(H,22,23,24)
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n/an/a 94n/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))
BDBM116519
PNG
(US8637532, 205)
Show SMILES CN(C)CC(Nc1ncnc2c(cccc12)C(N)=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C19H19Cl2N5O/c1-26(2)9-16(11-6-7-14(20)15(21)8-11)25-19-13-5-3-4-12(18(22)27)17(13)23-10-24-19/h3-8,10,16H,9H2,1-2H3,(H2,22,27)(H,23,24,25)
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n/an/a 140n/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))
BDBM116531
PNG
(US8637532, 217)
Show SMILES CN(C)CC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(Cl)c1
Show InChI InChI=1S/C19H20ClN5O/c1-25(2)10-16(12-5-3-6-13(20)9-12)24-19-15-8-4-7-14(18(21)26)17(15)22-11-23-19/h3-9,11,16H,10H2,1-2H3,(H2,21,26)(H,22,23,24)
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n/an/a 380n/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))
BDBM116554
PNG
(US8637532, 245)
Show SMILES CN(C)C[C@@H](Nc1ncnc2c(cccc12)C(N)=O)c1ccccc1
Show InChI InChI=1S/C19H21N5O/c1-24(2)11-16(13-7-4-3-5-8-13)23-19-15-10-6-9-14(18(20)25)17(15)21-12-22-19/h3-10,12,16H,11H2,1-2H3,(H2,20,25)(H,21,22,23)/t16-/m1/s1
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n/an/a 130n/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))
BDBM116587
PNG
(US8637532, 279)
Show SMILES CCNC[C@@H](Nc1ncnc2c(cccc12)C(N)=O)c1ccccc1
Show InChI InChI=1S/C19H21N5O/c1-2-21-11-16(13-7-4-3-5-8-13)24-19-15-10-6-9-14(18(20)25)17(15)22-12-23-19/h3-10,12,16,21H,2,11H2,1H3,(H2,20,25)(H,22,23,24)/t16-/m1/s1
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n/an/a 670n/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))
BDBM116490
PNG
(US8637532, 171)
Show SMILES C[C@@H](Nc1ncnc2c(cccc12)C(N)=O)c1ccccc1
Show InChI InChI=1S/C17H16N4O/c1-11(12-6-3-2-4-7-12)21-17-14-9-5-8-13(16(18)22)15(14)19-10-20-17/h2-11H,1H3,(H2,18,22)(H,19,20,21)/t11-/m1/s1
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n/an/a 2n/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))
BDBM116641
PNG
(US8637532, 340)
Show SMILES CC(C)N(C)C[C@@H](Nc1ncnc2c(cccc12)C(N)=O)c1ccccc1
Show InChI InChI=1S/C21H25N5O/c1-14(2)26(3)12-18(15-8-5-4-6-9-15)25-21-17-11-7-10-16(20(22)27)19(17)23-13-24-21/h4-11,13-14,18H,12H2,1-3H3,(H2,22,27)(H,23,24,25)/t18-/m1/s1
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n/an/a 140n/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))
BDBM116693
PNG
(US8637532, 397)
Show SMILES NC(=O)c1cccc2c(N[C@H](CNC3CC3)c3ccccc3)ncnc12
Show InChI InChI=1S/C20H21N5O/c21-19(26)15-7-4-8-16-18(15)23-12-24-20(16)25-17(11-22-14-9-10-14)13-5-2-1-3-6-13/h1-8,12,14,17,22H,9-11H2,(H2,21,26)(H,23,24,25)/t17-/m1/s1
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n/an/a 460n/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))
BDBM116384
PNG
(US8637532, 65)
Show SMILES NC[C@@H](Nc1ncnc2c(cccc12)C(N)=O)c1ccccc1
Show InChI InChI=1S/C17H17N5O/c18-9-14(11-5-2-1-3-6-11)22-17-13-8-4-7-12(16(19)23)15(13)20-10-21-17/h1-8,10,14H,9,18H2,(H2,19,23)(H,20,21,22)/t14-/m1/s1
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n/an/a 1.40n/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))
BDBM116490
PNG
(US8637532, 171)
Show SMILES C[C@@H](Nc1ncnc2c(cccc12)C(N)=O)c1ccccc1
Show InChI InChI=1S/C17H16N4O/c1-11(12-6-3-2-4-7-12)21-17-14-9-5-8-13(16(18)22)15(14)19-10-20-17/h2-11H,1H3,(H2,18,22)(H,19,20,21)/t11-/m1/s1
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n/an/a 0.820n/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))
BDBM116384
PNG
(US8637532, 65)
Show SMILES NC[C@@H](Nc1ncnc2c(cccc12)C(N)=O)c1ccccc1
Show InChI InChI=1S/C17H17N5O/c18-9-14(11-5-2-1-3-6-11)22-17-13-8-4-7-12(16(19)23)15(13)20-10-21-17/h1-8,10,14H,9,18H2,(H2,19,23)(H,20,21,22)/t14-/m1/s1
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n/an/a 0.600n/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