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Patent code US8975250

Compile Data Set for Download or QSAR
Found 13 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Calcium/calmodulin-dependent protein kinase type II subunit delta


(Homo sapiens (Human))		BDBM149450
PNG
(US8975250, 32)
Show SMILES CCn1c(N)c(C(N)=O)c(=O)c2cnc(Nc3ccc(cc3OC)N3CCC(CC3)N3CCOCC3)nc12
Show InChI InChI=1S/C26H34N8O4/c1-3-34-23(27)21(24(28)36)22(35)18-15-29-26(31-25(18)34)30-19-5-4-17(14-20(19)37-2)32-8-6-16(7-9-32)33-10-12-38-13-11-33/h4-5,14-16H,3,6-13,27H2,1-2H3,(H2,28,36)(H,29,30,31)
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US Patent


Assay Description
The kinase activity of CaMKII beta is evaluated by means of a radioactive test on the recombinant CaMKII beta enzyme. The amount of ATP-gamma 33P in...

US Patent US8975250 (2015)


BindingDB Entry DOI: 10.7270/Q2Z31XD8
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type II subunit delta


(Homo sapiens (Human))		BDBM149454
PNG
(US8975250, 61)
Show SMILES CCn1c(N)c(C(N)=O)c(=O)c2cnc(Nc3ccc(N4CCC(CC4)N4CCCC4)c(Cl)c3)nc12
Show InChI InChI=1S/C25H31ClN8O2/c1-2-34-22(27)20(23(28)36)21(35)17-14-29-25(31-24(17)34)30-15-5-6-19(18(26)13-15)33-11-7-16(8-12-33)32-9-3-4-10-32/h5-6,13-14,16H,2-4,7-12,27H2,1H3,(H2,28,36)(H,29,30,31)
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US Patent


Assay Description
The kinase activity of CaMKII beta is evaluated by means of a radioactive test on the recombinant CaMKII beta enzyme. The amount of ATP-gamma 33P in...

US Patent US8975250 (2015)


BindingDB Entry DOI: 10.7270/Q2Z31XD8
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type II subunit delta


(Homo sapiens (Human))		BDBM149449
PNG
(US8975250, 29)
Show SMILES CCn1c(N)c(C(N)=O)c(=O)c2cnc(Nc3ccc(cc3OC)C3CCN(CC3)C3CC3)nc12
Show InChI InChI=1S/C25H31N7O3/c1-3-32-22(26)20(23(27)34)21(33)17-13-28-25(30-24(17)32)29-18-7-4-15(12-19(18)35-2)14-8-10-31(11-9-14)16-5-6-16/h4,7,12-14,16H,3,5-6,8-11,26H2,1-2H3,(H2,27,34)(H,28,29,30)
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US Patent


Assay Description
The kinase activity of CaMKII beta is evaluated by means of a radioactive test on the recombinant CaMKII beta enzyme. The amount of ATP-gamma 33P in...

US Patent US8975250 (2015)


BindingDB Entry DOI: 10.7270/Q2Z31XD8
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type II subunit delta


(Homo sapiens (Human))		BDBM149451
PNG
(US8975250, 35)
Show SMILES CCn1c(N)c(C(N)=O)c(=O)c2cnc(Nc3ccc(cc3OC)C3CCN(CCC(F)(F)F)CC3)nc12
Show InChI InChI=1S/C25H30F3N7O3/c1-3-35-21(29)19(22(30)37)20(36)16-13-31-24(33-23(16)35)32-17-5-4-15(12-18(17)38-2)14-6-9-34(10-7-14)11-8-25(26,27)28/h4-5,12-14H,3,6-11,29H2,1-2H3,(H2,30,37)(H,31,32,33)
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US Patent


Assay Description
The kinase activity of CaMKII beta is evaluated by means of a radioactive test on the recombinant CaMKII beta enzyme. The amount of ATP-gamma 33P in...

US Patent US8975250 (2015)


BindingDB Entry DOI: 10.7270/Q2Z31XD8
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type II subunit delta


(Homo sapiens (Human))		BDBM149455
PNG
(US8975250, 75)
Show SMILES CCn1c(N)c(C(N)=O)c(=O)c2cnc(Nc3ccc4CNCCc4c3)nc12
Show InChI InChI=1S/C19H21N7O2/c1-2-26-16(20)14(17(21)28)15(27)13-9-23-19(25-18(13)26)24-12-4-3-11-8-22-6-5-10(11)7-12/h3-4,7,9,22H,2,5-6,8,20H2,1H3,(H2,21,28)(H,23,24,25)
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US Patent


Assay Description
The kinase activity of CaMKII beta is evaluated by means of a radioactive test on the recombinant CaMKII beta enzyme. The amount of ATP-gamma 33P in...

US Patent US8975250 (2015)


BindingDB Entry DOI: 10.7270/Q2Z31XD8
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type II subunit delta


(Homo sapiens (Human))		BDBM149459
PNG
(US8975250, 113)
Show SMILES COc1cc(ccc1Nc1ncc2c(n1)n(c(N)c(C(N)=O)c2=O)-c1ccccc1)C1CCNCC1
Show InChI InChI=1S/C26H27N7O3/c1-36-20-13-16(15-9-11-29-12-10-15)7-8-19(20)31-26-30-14-18-22(34)21(24(28)35)23(27)33(25(18)32-26)17-5-3-2-4-6-17/h2-8,13-15,29H,9-12,27H2,1H3,(H2,28,35)(H,30,31,32)
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US Patent


Assay Description
The kinase activity of CaMKII beta is evaluated by means of a radioactive test on the recombinant CaMKII beta enzyme. The amount of ATP-gamma 33P in...

US Patent US8975250 (2015)


BindingDB Entry DOI: 10.7270/Q2Z31XD8
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type II subunit delta


(Homo sapiens (Human))		BDBM149460
PNG
(US8975250, 114)
Show SMILES COc1cc(ccc1Nc1ncc2c(n1)n(CCO)c(N)c(C(N)=O)c2=O)C1CCNCC1
Show InChI InChI=1S/C22H27N7O4/c1-33-16-10-13(12-4-6-25-7-5-12)2-3-15(16)27-22-26-11-14-18(31)17(20(24)32)19(23)29(8-9-30)21(14)28-22/h2-3,10-12,25,30H,4-9,23H2,1H3,(H2,24,32)(H,26,27,28)
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US Patent


Assay Description
The kinase activity of CaMKII beta is evaluated by means of a radioactive test on the recombinant CaMKII beta enzyme. The amount of ATP-gamma 33P in...

US Patent US8975250 (2015)


BindingDB Entry DOI: 10.7270/Q2Z31XD8
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type II subunit delta


(Homo sapiens (Human))		BDBM149456
PNG
(US8975250, 76)
Show SMILES CCn1c(N)c(C(N)=O)c(=O)c2cnc(Nc3ccc(OC4CCN(C)CC4)cc3)nc12
Show InChI InChI=1S/C22H27N7O3/c1-3-29-19(23)17(20(24)31)18(30)16-12-25-22(27-21(16)29)26-13-4-6-14(7-5-13)32-15-8-10-28(2)11-9-15/h4-7,12,15H,3,8-11,23H2,1-2H3,(H2,24,31)(H,25,26,27)
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US Patent


Assay Description
The kinase activity of CaMKII beta is evaluated by means of a radioactive test on the recombinant CaMKII beta enzyme. The amount of ATP-gamma 33P in...

US Patent US8975250 (2015)


BindingDB Entry DOI: 10.7270/Q2Z31XD8
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type II subunit delta


(Homo sapiens (Human))		BDBM149452
PNG
(US8975250, 52)
Show SMILES CC(C)Cn1c(N)c(C(N)=O)c(=O)c2cnc(Nc3ccc(CCN4CCOCC4)cc3)nc12
Show InChI InChI=1S/C24H31N7O3/c1-15(2)14-31-21(25)19(22(26)33)20(32)18-13-27-24(29-23(18)31)28-17-5-3-16(4-6-17)7-8-30-9-11-34-12-10-30/h3-6,13,15H,7-12,14,25H2,1-2H3,(H2,26,33)(H,27,28,29)
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US Patent


Assay Description
The kinase activity of CaMKII beta is evaluated by means of a radioactive test on the recombinant CaMKII beta enzyme. The amount of ATP-gamma 33P in...

US Patent US8975250 (2015)


BindingDB Entry DOI: 10.7270/Q2Z31XD8
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type II subunit delta


(Homo sapiens (Human))		BDBM149448
PNG
(US8975250, 4)
Show SMILES CCn1c(N)c(C(N)=O)c(=O)c2cnc(Nc3ccc(cc3)C(=O)N3CCN(C)CC3)nc12
Show InChI InChI=1S/C22H26N8O3/c1-3-30-18(23)16(19(24)32)17(31)15-12-25-22(27-20(15)30)26-14-6-4-13(5-7-14)21(33)29-10-8-28(2)9-11-29/h4-7,12H,3,8-11,23H2,1-2H3,(H2,24,32)(H,25,26,27)
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US Patent


Assay Description
The kinase activity of CaMKII beta is evaluated by means of a radioactive test on the recombinant CaMKII beta enzyme. The amount of ATP-gamma 33P in...

US Patent US8975250 (2015)


BindingDB Entry DOI: 10.7270/Q2Z31XD8
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type II subunit delta


(Homo sapiens (Human))		BDBM149457
PNG
(US8975250, 78)
Show SMILES CCn1c(N)c(C(N)=O)c(=O)c2cnc(Nc3cccc(CN(C)C)c3)nc12
Show InChI InChI=1S/C19H23N7O2/c1-4-26-16(20)14(17(21)28)15(27)13-9-22-19(24-18(13)26)23-12-7-5-6-11(8-12)10-25(2)3/h5-9H,4,10,20H2,1-3H3,(H2,21,28)(H,22,23,24)
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Assay Description
The kinase activity of CaMKII beta is evaluated by means of a radioactive test on the recombinant CaMKII beta enzyme. The amount of ATP-gamma 33P in...

US Patent US8975250 (2015)


BindingDB Entry DOI: 10.7270/Q2Z31XD8
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type II subunit delta


(Homo sapiens (Human))		BDBM149458
PNG
(US8975250, 96)
Show SMILES CCc1cc(ccc1Nc1ncc2c(n1)n(CC)c(N)c(C(N)=O)c2=O)N1CCN(CC1)C1CC1
Show InChI InChI=1S/C25H32N8O2/c1-3-15-13-17(32-11-9-31(10-12-32)16-5-6-16)7-8-19(15)29-25-28-14-18-21(34)20(23(27)35)22(26)33(4-2)24(18)30-25/h7-8,13-14,16H,3-6,9-12,26H2,1-2H3,(H2,27,35)(H,28,29,30)
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Assay Description
The kinase activity of CaMKII beta is evaluated by means of a radioactive test on the recombinant CaMKII beta enzyme. The amount of ATP-gamma 33P in...

US Patent US8975250 (2015)


BindingDB Entry DOI: 10.7270/Q2Z31XD8
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type II subunit delta


(Homo sapiens (Human))		BDBM149453
PNG
(US8975250, 60)
Show SMILES CN(C)Cc1ccc(Nc2ncc3c(n2)n(CC(F)(F)F)c(N)c(C(N)=O)c3=O)cc1
Show InChI InChI=1S/C19H20F3N7O2/c1-28(2)8-10-3-5-11(6-4-10)26-18-25-7-12-14(30)13(16(24)31)15(23)29(17(12)27-18)9-19(20,21)22/h3-7H,8-9,23H2,1-2H3,(H2,24,31)(H,25,26,27)
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Assay Description
The kinase activity of CaMKII beta is evaluated by means of a radioactive test on the recombinant CaMKII beta enzyme. The amount of ATP-gamma 33P in...

US Patent US8975250 (2015)


BindingDB Entry DOI: 10.7270/Q2Z31XD8
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%