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16 similar compounds to monomer 50352303

Compile data set for download or QSAR
Wt: 405.4
BDBM50352297
Wt: 559.6
BDBM50352299
Wt: 547.6
BDBM50352300
Wt: 531.6
BDBM50352301
Wt: 561.6
BDBM50352302
Wt: 422.5
BDBM50352312
Wt: 464.5
BDBM50352313
Wt: 462.5
BDBM50352314
Wt: 434.5
BDBM50352315
Wt: 559.6
BDBM50394784
Wt: 545.6
BDBM50394786
Wt: 545.6
BDBM50394787
Wt: 533.6
BDBM50394793
Wt: 547.6
BDBM50394777
Wt: 545.6
BDBM50394778
Displayed 1 to 15 (of 16 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 57 hits for monomerid = 50352297,50352299,50352300,50352301,50352302,50352312,50352313,50352314,50352315,50394784,50394786,50394787,50394793,50394777,50394778   
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
Aurora kinase B


(Homo sapiens (Human))
BDBM50352312
PNG
(CHEMBL1822494)
Show SMILES CN(C)CC(=O)Nc1ccc(Sc2nc(Nc3cc(C)[nH]n3)c3cccn3n2)cc1
Show InChI InChI=1S/C20H22N8OS/c1-13-11-17(25-24-13)22-19-16-5-4-10-28(16)26-20(23-19)30-15-8-6-14(7-9-15)21-18(29)12-27(2)3/h4-11H,12H2,1-3H3,(H,21,29)(H2,22,23,24,25,26)
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n/an/a 293n/an/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Inhibition of Aurora B kinase assessed as reduction in histone H3 phosphorylation in human HCT116 cells


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM50394793
PNG
(CHEMBL2163413)
Show SMILES CC(C)C(=O)N[C@@H]1CCN(CC(=O)Nc2ccc(Sc3nc(Nc4cc(C)[nH]n4)c4cccn4n3)cc2)C1
Show InChI InChI=1S/C26H31N9O2S/c1-16(2)25(37)28-19-10-12-34(14-19)15-23(36)27-18-6-8-20(9-7-18)38-26-30-24(21-5-4-11-35(21)33-26)29-22-13-17(3)31-32-22/h4-9,11,13,16,19H,10,12,14-15H2,1-3H3,(H,27,36)(H,28,37)(H2,29,30,31,32,33)/t19-/m1/s1
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n/an/an/a 13n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase A autophosphorylation in human HEK293 cells after 2 hrs by phosphor antibody readout assay


J Med Chem 55: 3250-60 (2012)


Article DOI: 10.1021/jm201702g
BindingDB Entry DOI: 10.7270/Q2W0971F
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50352313
PNG
(CHEMBL1822493)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CCOCC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C22H24N8O2S/c1-15-13-19(27-26-15)24-21-18-3-2-8-30(18)28-22(25-21)33-17-6-4-16(5-7-17)23-20(31)14-29-9-11-32-12-10-29/h2-8,13H,9-12,14H2,1H3,(H,23,31)(H2,24,25,26,27,28)
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n/an/a 1.83E+3n/an/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Inhibition of Aurora B kinase assessed as reduction in histone H3 phosphorylation in human HCT116 cells


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50352315
PNG
(CHEMBL1822491)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CNC4CC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C21H22N8OS/c1-13-11-18(27-26-13)24-20-17-3-2-10-29(17)28-21(25-20)31-16-8-6-15(7-9-16)23-19(30)12-22-14-4-5-14/h2-3,6-11,14,22H,4-5,12H2,1H3,(H,23,30)(H2,24,25,26,27,28)
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n/an/a 288n/an/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Inhibition of Aurora B kinase assessed as reduction in histone H3 phosphorylation in human HCT116 cells


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50352300
PNG
(CHEMBL1822487)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CN4CCOCC4)cc23)[nH]n1
Show InChI InChI=1S/C26H29N9O3S/c1-16-12-22(32-31-16)29-24-21-13-19(27-23(36)15-34-8-10-38-11-9-34)14-35(21)33-26(30-24)39-20-6-4-18(5-7-20)28-25(37)17-2-3-17/h4-7,12-14,17H,2-3,8-11,15H2,1H3,(H,27,36)(H,28,37)(H2,29,30,31,32,33)
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n/an/an/a 9n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora B kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50352302
PNG
(CHEMBL1822489)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CN4CCC[C@@H]4CO)cc23)[nH]n1
Show InChI InChI=1S/C27H31N9O3S/c1-16-11-23(33-32-16)30-25-22-12-19(28-24(38)14-35-10-2-3-20(35)15-37)13-36(22)34-27(31-25)40-21-8-6-18(7-9-21)29-26(39)17-4-5-17/h6-9,11-13,17,20,37H,2-5,10,14-15H2,1H3,(H,28,38)(H,29,39)(H2,30,31,32,33,34)/t20-/m1/s1
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n/an/a 6.30E+3n/an/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Inhibition of Aurora B kinase assessed as reduction in histone H3 phosphorylation in human HCT116 cells


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50352301
PNG
(CHEMBL1822488)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CN4CCCC4)cc23)[nH]n1
Show InChI InChI=1S/C26H29N9O2S/c1-16-12-22(32-31-16)29-24-21-13-19(27-23(36)15-34-10-2-3-11-34)14-35(21)33-26(30-24)38-20-8-6-18(7-9-20)28-25(37)17-4-5-17/h6-9,12-14,17H,2-5,10-11,15H2,1H3,(H,27,36)(H,28,37)(H2,29,30,31,32,33)
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n/an/an/a 49n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora B kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50352297
PNG
(CHEMBL1822485)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C20H19N7OS/c1-12-11-17(25-24-12)22-18-16-3-2-10-27(16)26-20(23-18)29-15-8-6-14(7-9-15)21-19(28)13-4-5-13/h2-3,6-11,13H,4-5H2,1H3,(H,21,28)(H2,22,23,24,25,26)
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n/an/an/a 20n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora B kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50352299
PNG
(CHEMBL1822486)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CCN4CCCCC4)cc23)[nH]n1
Show InChI InChI=1S/C28H33N9O2S/c1-18-15-24(34-33-18)31-26-23-16-21(29-25(38)11-14-36-12-3-2-4-13-36)17-37(23)35-28(32-26)40-22-9-7-20(8-10-22)30-27(39)19-5-6-19/h7-10,15-17,19H,2-6,11-14H2,1H3,(H,29,38)(H,30,39)(H2,31,32,33,34,35)
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n/an/an/a 37n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora B kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50352312
PNG
(CHEMBL1822494)
Show SMILES CN(C)CC(=O)Nc1ccc(Sc2nc(Nc3cc(C)[nH]n3)c3cccn3n2)cc1
Show InChI InChI=1S/C20H22N8OS/c1-13-11-17(25-24-13)22-19-16-5-4-10-28(16)26-20(23-19)30-15-8-6-14(7-9-15)21-18(29)12-27(2)3/h4-11H,12H2,1-3H3,(H,21,29)(H2,22,23,24,25,26)
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n/an/an/a 8n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora B kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50352300
PNG
(CHEMBL1822487)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CN4CCOCC4)cc23)[nH]n1
Show InChI InChI=1S/C26H29N9O3S/c1-16-12-22(32-31-16)29-24-21-13-19(27-23(36)15-34-8-10-38-11-9-34)14-35(21)33-26(30-24)39-20-6-4-18(5-7-20)28-25(37)17-2-3-17/h4-7,12-14,17H,2-3,8-11,15H2,1H3,(H,27,36)(H,28,37)(H2,29,30,31,32,33)
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n/an/a 420n/an/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Inhibition of Aurora B kinase assessed as reduction in histone H3 phosphorylation in human HCT116 cells


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50352314
PNG
(CHEMBL1822492)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CNC4CCCC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C23H26N8OS/c1-15-13-20(29-28-15)26-22-19-7-4-12-31(19)30-23(27-22)33-18-10-8-17(9-11-18)25-21(32)14-24-16-5-2-3-6-16/h4,7-13,16,24H,2-3,5-6,14H2,1H3,(H,25,32)(H2,26,27,28,29,30)
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n/an/an/a 42n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora B kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50352301
PNG
(CHEMBL1822488)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CN4CCCC4)cc23)[nH]n1
Show InChI InChI=1S/C26H29N9O2S/c1-16-12-22(32-31-16)29-24-21-13-19(27-23(36)15-34-10-2-3-11-34)14-35(21)33-26(30-24)38-20-8-6-18(7-9-20)28-25(37)17-4-5-17/h6-9,12-14,17H,2-5,10-11,15H2,1H3,(H,27,36)(H,28,37)(H2,29,30,31,32,33)
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n/an/a 828n/an/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Inhibition of Aurora B kinase assessed as reduction in histone H3 phosphorylation in human HCT116 cells


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50352313
PNG
(CHEMBL1822493)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CCOCC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C22H24N8O2S/c1-15-13-19(27-26-15)24-21-18-3-2-8-30(18)28-22(25-21)33-17-6-4-16(5-7-17)23-20(31)14-29-9-11-32-12-10-29/h2-8,13H,9-12,14H2,1H3,(H,23,31)(H2,24,25,26,27,28)
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n/an/an/a 41n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora B kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50352297
PNG
(CHEMBL1822485)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C20H19N7OS/c1-12-11-17(25-24-12)22-18-16-3-2-10-27(16)26-20(23-18)29-15-8-6-14(7-9-15)21-19(28)13-4-5-13/h2-3,6-11,13H,4-5H2,1H3,(H,21,28)(H2,22,23,24,25,26)
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n/an/a 431n/an/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Inhibition of Aurora B kinase assessed as reduction in histone H3 phosphorylation in human HCT116 cells


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50352299
PNG
(CHEMBL1822486)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CCN4CCCCC4)cc23)[nH]n1
Show InChI InChI=1S/C28H33N9O2S/c1-18-15-24(34-33-18)31-26-23-16-21(29-25(38)11-14-36-12-3-2-4-13-36)17-37(23)35-28(32-26)40-22-9-7-20(8-10-22)30-27(39)19-5-6-19/h7-10,15-17,19H,2-6,11-14H2,1H3,(H,29,38)(H,30,39)(H2,31,32,33,34,35)
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n/an/a 850n/an/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Inhibition of Aurora B kinase assessed as reduction in histone H3 phosphorylation in human HCT116 cells


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50352315
PNG
(CHEMBL1822491)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CNC4CC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C21H22N8OS/c1-13-11-18(27-26-13)24-20-17-3-2-10-29(17)28-21(25-20)31-16-8-6-15(7-9-16)23-19(30)12-22-14-4-5-14/h2-3,6-11,14,22H,4-5,12H2,1H3,(H,23,30)(H2,24,25,26,27,28)
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n/an/an/a 41n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora B kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50352302
PNG
(CHEMBL1822489)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CN4CCC[C@@H]4CO)cc23)[nH]n1
Show InChI InChI=1S/C27H31N9O3S/c1-16-11-23(33-32-16)30-25-22-12-19(28-24(38)14-35-10-2-3-20(35)15-37)13-36(22)34-27(31-25)40-21-8-6-18(7-9-21)29-26(39)17-4-5-17/h6-9,11-13,17,20,37H,2-5,10,14-15H2,1H3,(H,28,38)(H,29,39)(H2,30,31,32,33,34)/t20-/m1/s1
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n/an/an/a 16n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora B kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50394786
PNG
(CHEMBL2163403)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)N4CCCC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C27H31N9O2S/c1-18-15-23(32-31-18)29-25-22-5-4-13-36(22)33-27(30-25)39-21-8-6-20(7-9-21)28-24(37)17-34-14-10-19(16-34)26(38)35-11-2-3-12-35/h4-9,13,15,19H,2-3,10-12,14,16-17H2,1H3,(H,28,37)(H2,29,30,31,32,33)/t19-/m1/s1
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n/an/a 6.30n/an/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase B-mediated histone H3 Ser10 phosphorylation in human HCT116 cells after 2 hrs by sandwich ELISA


J Med Chem 55: 3250-60 (2012)


Article DOI: 10.1021/jm201702g
BindingDB Entry DOI: 10.7270/Q2W0971F
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50394777
PNG
(CHEMBL2163387)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)NC(C)(C)C)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C27H33N9O2S/c1-17-14-22(33-32-17)29-24-21-6-5-12-36(21)34-26(30-24)39-20-9-7-19(8-10-20)28-23(37)16-35-13-11-18(15-35)25(38)31-27(2,3)4/h5-10,12,14,18H,11,13,15-16H2,1-4H3,(H,28,37)(H,31,38)(H2,29,30,32,33,34)/t18-/m1/s1
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n/an/an/a 3.10n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora kinase B catalytic domain by competition binding assay


J Med Chem 55: 3250-60 (2012)


Article DOI: 10.1021/jm201702g
BindingDB Entry DOI: 10.7270/Q2W0971F
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50394784
PNG
(CHEMBL2163389)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)N4CCCCC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C28H33N9O2S/c1-19-16-24(33-32-19)30-26-23-6-5-14-37(23)34-28(31-26)40-22-9-7-21(8-10-22)29-25(38)18-35-15-11-20(17-35)27(39)36-12-3-2-4-13-36/h5-10,14,16,20H,2-4,11-13,15,17-18H2,1H3,(H,29,38)(H2,30,31,32,33,34)/t20-/m1/s1
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n/an/an/a 2.90n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora kinase B catalytic domain by competition binding assay


J Med Chem 55: 3250-60 (2012)


Article DOI: 10.1021/jm201702g
BindingDB Entry DOI: 10.7270/Q2W0971F
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50394778
PNG
(CHEMBL2163395)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)NC4CCC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C27H31N9O2S/c1-17-14-23(33-32-17)30-25-22-6-3-12-36(22)34-27(31-25)39-21-9-7-20(8-10-21)28-24(37)16-35-13-11-18(15-35)26(38)29-19-4-2-5-19/h3,6-10,12,14,18-19H,2,4-5,11,13,15-16H2,1H3,(H,28,37)(H,29,38)(H2,30,31,32,33,34)/t18-/m1/s1
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n/an/an/a 3.30n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora kinase B catalytic domain by competition binding assay


J Med Chem 55: 3250-60 (2012)


Article DOI: 10.1021/jm201702g
BindingDB Entry DOI: 10.7270/Q2W0971F
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50394793
PNG
(CHEMBL2163413)
Show SMILES CC(C)C(=O)N[C@@H]1CCN(CC(=O)Nc2ccc(Sc3nc(Nc4cc(C)[nH]n4)c4cccn4n3)cc2)C1
Show InChI InChI=1S/C26H31N9O2S/c1-16(2)25(37)28-19-10-12-34(14-19)15-23(36)27-18-6-8-20(9-7-18)38-26-30-24(21-5-4-11-35(21)33-26)29-22-13-17(3)31-32-22/h4-9,11,13,16,19H,10,12,14-15H2,1-3H3,(H,27,36)(H,28,37)(H2,29,30,31,32,33)/t19-/m1/s1
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n/an/a 114n/an/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase B-mediated histone H3 Ser10 phosphorylation in human HCT116 cells after 2 hrs by sandwich ELISA


J Med Chem 55: 3250-60 (2012)


Article DOI: 10.1021/jm201702g
BindingDB Entry DOI: 10.7270/Q2W0971F
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50394786
PNG
(CHEMBL2163403)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)N4CCCC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C27H31N9O2S/c1-18-15-23(32-31-18)29-25-22-5-4-13-36(22)33-27(30-25)39-21-8-6-20(7-9-21)28-24(37)17-34-14-10-19(16-34)26(38)35-11-2-3-12-35/h4-9,13,15,19H,2-3,10-12,14,16-17H2,1H3,(H,28,37)(H2,29,30,31,32,33)/t19-/m1/s1
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n/an/an/a 2.40n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora kinase B catalytic domain by competition binding assay


J Med Chem 55: 3250-60 (2012)


Article DOI: 10.1021/jm201702g
BindingDB Entry DOI: 10.7270/Q2W0971F
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50394787
PNG
(CHEMBL2163402)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@@H](C4)C(=O)N4CCCC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C27H31N9O2S/c1-18-15-23(32-31-18)29-25-22-5-4-13-36(22)33-27(30-25)39-21-8-6-20(7-9-21)28-24(37)17-34-14-10-19(16-34)26(38)35-11-2-3-12-35/h4-9,13,15,19H,2-3,10-12,14,16-17H2,1H3,(H,28,37)(H2,29,30,31,32,33)/t19-/m0/s1
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n/an/an/a 1.90n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora kinase B catalytic domain by competition binding assay


J Med Chem 55: 3250-60 (2012)


Article DOI: 10.1021/jm201702g
BindingDB Entry DOI: 10.7270/Q2W0971F
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM50394786
PNG
(CHEMBL2163403)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)N4CCCC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C27H31N9O2S/c1-18-15-23(32-31-18)29-25-22-5-4-13-36(22)33-27(30-25)39-21-8-6-20(7-9-21)28-24(37)17-34-14-10-19(16-34)26(38)35-11-2-3-12-35/h4-9,13,15,19H,2-3,10-12,14,16-17H2,1H3,(H,28,37)(H2,29,30,31,32,33)/t19-/m1/s1
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n/an/an/a 8.80n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora kinase A catalytic domain by competition binding assay


J Med Chem 55: 3250-60 (2012)


Article DOI: 10.1021/jm201702g
BindingDB Entry DOI: 10.7270/Q2W0971F
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50394777
PNG
(CHEMBL2163387)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)NC(C)(C)C)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C27H33N9O2S/c1-17-14-22(33-32-17)29-24-21-6-5-12-36(21)34-26(30-24)39-20-9-7-19(8-10-20)28-23(37)16-35-13-11-18(15-35)25(38)31-27(2,3)4/h5-10,12,14,18H,11,13,15-16H2,1-4H3,(H,28,37)(H,31,38)(H2,29,30,32,33,34)/t18-/m1/s1
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n/an/a 6.20n/an/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase B-mediated histone H3 Ser10 phosphorylation in human HCT116 cells after 2 hrs by sandwich ELISA


J Med Chem 55: 3250-60 (2012)


Article DOI: 10.1021/jm201702g
BindingDB Entry DOI: 10.7270/Q2W0971F
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50394786
PNG
(CHEMBL2163403)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)N4CCCC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C27H31N9O2S/c1-18-15-23(32-31-18)29-25-22-5-4-13-36(22)33-27(30-25)39-21-8-6-20(7-9-21)28-24(37)17-34-14-10-19(16-34)26(38)35-11-2-3-12-35/h4-9,13,15,19H,2-3,10-12,14,16-17H2,1H3,(H,28,37)(H2,29,30,31,32,33)/t19-/m1/s1
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n/an/an/a 2.5n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora kinase B catalytic domain by competition binding assay


J Med Chem 55: 3250-60 (2012)


Article DOI: 10.1021/jm201702g
BindingDB Entry DOI: 10.7270/Q2W0971F
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50394784
PNG
(CHEMBL2163389)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)N4CCCCC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C28H33N9O2S/c1-19-16-24(33-32-19)30-26-23-6-5-14-37(23)34-28(31-26)40-22-9-7-21(8-10-22)29-25(38)18-35-15-11-20(17-35)27(39)36-12-3-2-4-13-36/h5-10,14,16,20H,2-4,11-13,15,17-18H2,1H3,(H,29,38)(H2,30,31,32,33,34)/t20-/m1/s1
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n/an/a 10n/an/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase B-mediated histone H3 Ser10 phosphorylation in human HCT116 cells after 2 hrs by sandwich ELISA


J Med Chem 55: 3250-60 (2012)


Article DOI: 10.1021/jm201702g
BindingDB Entry DOI: 10.7270/Q2W0971F
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50394786
PNG
(CHEMBL2163403)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)N4CCCC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C27H31N9O2S/c1-18-15-23(32-31-18)29-25-22-5-4-13-36(22)33-27(30-25)39-21-8-6-20(7-9-21)28-24(37)17-34-14-10-19(16-34)26(38)35-11-2-3-12-35/h4-9,13,15,19H,2-3,10-12,14,16-17H2,1H3,(H,28,37)(H2,29,30,31,32,33)/t19-/m1/s1
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n/an/a 9n/an/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase B-mediated histone H3 Ser10 phosphorylation in human HCT116 cells after 2 hrs by sandwich ELISA


J Med Chem 55: 3250-60 (2012)


Article DOI: 10.1021/jm201702g
BindingDB Entry DOI: 10.7270/Q2W0971F
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50394778
PNG
(CHEMBL2163395)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@H](C4)C(=O)NC4CCC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C27H31N9O2S/c1-17-14-23(33-32-17)30-25-22-6-3-12-36(22)34-27(31-25)39-21-9-7-20(8-10-21)28-24(37)16-35-13-11-18(15-35)26(38)29-19-4-2-5-19/h3,6-10,12,14,18-19H,2,4-5,11,13,15-16H2,1H3,(H,28,37)(H,29,38)(H2,30,31,32,33,34)/t18-/m1/s1
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n/an/a 9.30n/an/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase B-mediated histone H3 Ser10 phosphorylation in human HCT116 cells after 2 hrs by sandwich ELISA


J Med Chem 55: 3250-60 (2012)


Article DOI: 10.1021/jm201702g
BindingDB Entry DOI: 10.7270/Q2W0971F
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50394787
PNG
(CHEMBL2163402)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CC[C@@H](C4)C(=O)N4CCCC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C27H31N9O2S/c1-18-15-23(32-31-18)29-25-22-5-4-13-36(22)33-27(30-25)39-21-8-6-20(7-9-21)28-24(37)17-34-14-10-19(16-34)26(38)35-11-2-3-12-35/h4-9,13,15,19H,2-3,10-12,14,16-17H2,1H3,(H,28,37)(H2,29,30,31,32,33)/t19-/m0/s1
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n/an/a 38n/an/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Inhibition of Aurora kinase B-mediated histone H3 Ser10 phosphorylation in human HCT116 cells after 2 hrs by sandwich ELISA


J Med Chem 55: 3250-60 (2012)


Article DOI: 10.1021/jm201702g
BindingDB Entry DOI: 10.7270/Q2W0971F
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50394793
PNG
(CHEMBL2163413)
Show SMILES CC(C)C(=O)N[C@@H]1CCN(CC(=O)Nc2ccc(Sc3nc(Nc4cc(C)[nH]n4)c4cccn4n3)cc2)C1
Show InChI InChI=1S/C26H31N9O2S/c1-16(2)25(37)28-19-10-12-34(14-19)15-23(36)27-18-6-8-20(9-7-18)38-26-30-24(21-5-4-11-35(21)33-26)29-22-13-17(3)31-32-22/h4-9,11,13,16,19H,10,12,14-15H2,1-3H3,(H,27,36)(H,28,37)(H2,29,30,31,32,33)/t19-/m1/s1
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n/an/an/a 5.70n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora kinase B catalytic domain by competition binding assay


J Med Chem 55: 3250-60 (2012)


Article DOI: 10.1021/jm201702g
BindingDB Entry DOI: 10.7270/Q2W0971F
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Aurora-C


(Homo sapiens (Human))
BDBM50352297
PNG
(CHEMBL1822485)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C20H19N7OS/c1-12-11-17(25-24-12)22-18-16-3-2-10-27(16)26-20(23-18)29-15-8-6-14(7-9-15)21-19(28)13-4-5-13/h2-3,6-11,13H,4-5H2,1H3,(H,21,28)(H2,22,23,24,25,26)
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n/an/an/a 4n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora C kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM50352297
PNG
(CHEMBL1822485)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C20H19N7OS/c1-12-11-17(25-24-12)22-18-16-3-2-10-27(16)26-20(23-18)29-15-8-6-14(7-9-15)21-19(28)13-4-5-13/h2-3,6-11,13H,4-5H2,1H3,(H,21,28)(H2,22,23,24,25,26)
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n/an/an/a 12n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora A kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM50352299
PNG
(CHEMBL1822486)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CCN4CCCCC4)cc23)[nH]n1
Show InChI InChI=1S/C28H33N9O2S/c1-18-15-24(34-33-18)31-26-23-16-21(29-25(38)11-14-36-12-3-2-4-13-36)17-37(23)35-28(32-26)40-22-9-7-20(8-10-22)30-27(39)19-5-6-19/h7-10,15-17,19H,2-6,11-14H2,1H3,(H,29,38)(H,30,39)(H2,31,32,33,34,35)
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n/an/an/a 38n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora A kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Aurora-C


(Homo sapiens (Human))
BDBM50352299
PNG
(CHEMBL1822486)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CCN4CCCCC4)cc23)[nH]n1
Show InChI InChI=1S/C28H33N9O2S/c1-18-15-24(34-33-18)31-26-23-16-21(29-25(38)11-14-36-12-3-2-4-13-36)17-37(23)35-28(32-26)40-22-9-7-20(8-10-22)30-27(39)19-5-6-19/h7-10,15-17,19H,2-6,11-14H2,1H3,(H,29,38)(H,30,39)(H2,31,32,33,34,35)
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n/an/an/a 10n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora C kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM50352300
PNG
(CHEMBL1822487)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CN4CCOCC4)cc23)[nH]n1
Show InChI InChI=1S/C26H29N9O3S/c1-16-12-22(32-31-16)29-24-21-13-19(27-23(36)15-34-8-10-38-11-9-34)14-35(21)33-26(30-24)39-20-6-4-18(5-7-20)28-25(37)17-2-3-17/h4-7,12-14,17H,2-3,8-11,15H2,1H3,(H,27,36)(H,28,37)(H2,29,30,31,32,33)
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n/an/an/a 7n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora A kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Aurora-C


(Homo sapiens (Human))
BDBM50352300
PNG
(CHEMBL1822487)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CN4CCOCC4)cc23)[nH]n1
Show InChI InChI=1S/C26H29N9O3S/c1-16-12-22(32-31-16)29-24-21-13-19(27-23(36)15-34-8-10-38-11-9-34)14-35(21)33-26(30-24)39-20-6-4-18(5-7-20)28-25(37)17-2-3-17/h4-7,12-14,17H,2-3,8-11,15H2,1H3,(H,27,36)(H,28,37)(H2,29,30,31,32,33)
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n/an/an/a 3n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora C kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM50352301
PNG
(CHEMBL1822488)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CN4CCCC4)cc23)[nH]n1
Show InChI InChI=1S/C26H29N9O2S/c1-16-12-22(32-31-16)29-24-21-13-19(27-23(36)15-34-10-2-3-11-34)14-35(21)33-26(30-24)38-20-8-6-18(7-9-20)28-25(37)17-4-5-17/h6-9,12-14,17H,2-5,10-11,15H2,1H3,(H,27,36)(H,28,37)(H2,29,30,31,32,33)
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n/an/an/a 23n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora A kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Aurora-C


(Homo sapiens (Human))
BDBM50352301
PNG
(CHEMBL1822488)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CN4CCCC4)cc23)[nH]n1
Show InChI InChI=1S/C26H29N9O2S/c1-16-12-22(32-31-16)29-24-21-13-19(27-23(36)15-34-10-2-3-11-34)14-35(21)33-26(30-24)38-20-8-6-18(7-9-20)28-25(37)17-4-5-17/h6-9,12-14,17H,2-5,10-11,15H2,1H3,(H,27,36)(H,28,37)(H2,29,30,31,32,33)
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n/an/an/a 13n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora C kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM50352302
PNG
(CHEMBL1822489)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CN4CCC[C@@H]4CO)cc23)[nH]n1
Show InChI InChI=1S/C27H31N9O3S/c1-16-11-23(33-32-16)30-25-22-12-19(28-24(38)14-35-10-2-3-20(35)15-37)13-36(22)34-27(31-25)40-21-8-6-18(7-9-21)29-26(39)17-4-5-17/h6-9,11-13,17,20,37H,2-5,10,14-15H2,1H3,(H,28,38)(H,29,39)(H2,30,31,32,33,34)/t20-/m1/s1
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n/an/an/a 10n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora A kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Aurora-C


(Homo sapiens (Human))
BDBM50352302
PNG
(CHEMBL1822489)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)C4CC4)cc3)nn3cc(NC(=O)CN4CCC[C@@H]4CO)cc23)[nH]n1
Show InChI InChI=1S/C27H31N9O3S/c1-16-11-23(33-32-16)30-25-22-12-19(28-24(38)14-35-10-2-3-20(35)15-37)13-36(22)34-27(31-25)40-21-8-6-18(7-9-21)29-26(39)17-4-5-17/h6-9,11-13,17,20,37H,2-5,10,14-15H2,1H3,(H,28,38)(H,29,39)(H2,30,31,32,33,34)/t20-/m1/s1
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n/an/an/a 80n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora C kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Aurora-C


(Homo sapiens (Human))
BDBM50352312
PNG
(CHEMBL1822494)
Show SMILES CN(C)CC(=O)Nc1ccc(Sc2nc(Nc3cc(C)[nH]n3)c3cccn3n2)cc1
Show InChI InChI=1S/C20H22N8OS/c1-13-11-17(25-24-13)22-19-16-5-4-10-28(16)26-20(23-19)30-15-8-6-14(7-9-15)21-18(29)12-27(2)3/h4-11H,12H2,1-3H3,(H,21,29)(H2,22,23,24,25,26)
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n/an/an/a 5n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora C kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM50352312
PNG
(CHEMBL1822494)
Show SMILES CN(C)CC(=O)Nc1ccc(Sc2nc(Nc3cc(C)[nH]n3)c3cccn3n2)cc1
Show InChI InChI=1S/C20H22N8OS/c1-13-11-17(25-24-13)22-19-16-5-4-10-28(16)26-20(23-19)30-15-8-6-14(7-9-15)21-18(29)12-27(2)3/h4-11H,12H2,1-3H3,(H,21,29)(H2,22,23,24,25,26)
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n/an/an/a 31n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora A kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Aurora-C


(Homo sapiens (Human))
BDBM50352313
PNG
(CHEMBL1822493)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CCOCC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C22H24N8O2S/c1-15-13-19(27-26-15)24-21-18-3-2-8-30(18)28-22(25-21)33-17-6-4-16(5-7-17)23-20(31)14-29-9-11-32-12-10-29/h2-8,13H,9-12,14H2,1H3,(H,23,31)(H2,24,25,26,27,28)
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Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora C kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM50352313
PNG
(CHEMBL1822493)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CN4CCOCC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C22H24N8O2S/c1-15-13-19(27-26-15)24-21-18-3-2-8-30(18)28-22(25-21)33-17-6-4-16(5-7-17)23-20(31)14-29-9-11-32-12-10-29/h2-8,13H,9-12,14H2,1H3,(H,23,31)(H2,24,25,26,27,28)
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n/an/an/a 85n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora A kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Aurora-C


(Homo sapiens (Human))
BDBM50352314
PNG
(CHEMBL1822492)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CNC4CCCC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C23H26N8OS/c1-15-13-20(29-28-15)26-22-19-7-4-12-31(19)30-23(27-22)33-18-10-8-17(9-11-18)25-21(32)14-24-16-5-2-3-6-16/h4,7-13,16,24H,2-3,5-6,14H2,1H3,(H,25,32)(H2,26,27,28,29,30)
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n/an/an/a 14n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora C kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM50352314
PNG
(CHEMBL1822492)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CNC4CCCC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C23H26N8OS/c1-15-13-20(29-28-15)26-22-19-7-4-12-31(19)30-23(27-22)33-18-10-8-17(9-11-18)25-21(32)14-24-16-5-2-3-6-16/h4,7-13,16,24H,2-3,5-6,14H2,1H3,(H,25,32)(H2,26,27,28,29,30)
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n/an/an/a 143n/an/an/an/an/a



Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora A kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase Aurora-C


(Homo sapiens (Human))
BDBM50352315
PNG
(CHEMBL1822491)
Show SMILES Cc1cc(Nc2nc(Sc3ccc(NC(=O)CNC4CC4)cc3)nn3cccc23)n[nH]1
Show InChI InChI=1S/C21H22N8OS/c1-13-11-18(27-26-13)24-20-17-3-2-10-29(17)28-21(25-20)31-16-8-6-15(7-9-16)23-19(30)12-22-14-4-5-14/h2-3,6-11,14,22H,4-5,12H2,1H3,(H,23,30)(H2,24,25,26,27,28)
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Ambit Biosciences Corporation

Curated by ChEMBL


Assay Description
Binding affinity to Aurora C kinase catalytic domain by competitive binding assay


Bioorg Med Chem Lett 21: 5296-300 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.027
BindingDB Entry DOI: 10.7270/Q20P10D8
More data for this
Ligand-Target Pair
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