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Patent code US8742113

Compile Data Set for Download or QSAR
Found 21 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
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123148
PNG
(US8742113, 242)
Show SMILES Cc1ccsc1CN=C1CC(=O)C(O1)=Cc1c[nH]c2ncccc12 |w:14.16,7.7|
Show InChI InChI=1S/C18H15N3O2S/c1-11-4-6-24-16(11)10-20-17-8-14(22)15(23-17)7-12-9-21-18-13(12)3-2-5-19-18/h2-7,9H,8,10H2,1H3,(H,19,21)/b15-7-,20-17-
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n/an/a 1n/an/an/an/a7.5n/a



SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123147
PNG
(US8742113, 239)
Show SMILES O=C1CC(OC1=Cc1c[nH]c2ncccc12)=Nc1ccc2[nH]ncc2c1 |w:6.7,16.19|
Show InChI InChI=1S/C19H13N5O2/c25-16-8-18(23-13-3-4-15-12(6-13)10-22-24-15)26-17(16)7-11-9-21-19-14(11)2-1-5-20-19/h1-7,9-10H,8H2,(H,20,21)(H,22,24)/b17-7-,23-18+
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n/an/a 1n/an/an/an/a7.5n/a



SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123146
PNG
(US8742113, 233)
Show SMILES Cc1cc(F)ccc1N=C1CC(=O)C(O1)=Cc1c[nH]c2ncccc12 |w:15.17,8.8|
Show InChI InChI=1S/C19H14FN3O2/c1-11-7-13(20)4-5-15(11)23-18-9-16(24)17(25-18)8-12-10-22-19-14(12)3-2-6-21-19/h2-8,10H,9H2,1H3,(H,21,22)/b17-8-,23-18+
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SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123131
PNG
(US8742113, 15)
Show SMILES CCOC(=O)C1C(=O)C(OC1=Nc1ccccc1Cl)=Cc1c[nH]c2ncccc12 |w:19.21,11.12|
Show InChI InChI=1S/C21H16ClN3O4/c1-2-28-21(27)17-18(26)16(10-12-11-24-19-13(12)6-5-9-23-19)29-20(17)25-15-8-4-3-7-14(15)22/h3-11,17H,2H2,1H3,(H,23,24)/b16-10-,25-20-
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SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123142
PNG
(US8742113, 142)
Show SMILES CCOC(=O)C1C(OC(=Cc2c[nH]c3ncccc23)C1=O)=NN1CCOCC1 |w:9.9,21.24|
Show InChI InChI=1S/C19H20N4O5/c1-2-27-19(25)15-16(24)14(28-18(15)22-23-6-8-26-9-7-23)10-12-11-21-17-13(12)4-3-5-20-17/h3-5,10-11,15H,2,6-9H2,1H3,(H,20,21)/b14-10-,22-18-
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SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123140
PNG
(US8742113, 126)
Show SMILES CCOC(=O)C1C(=O)C(OC1=Nc1ccc(NCCO)cc1C)=Cc1c[nH]c2ncccc12 |w:23.25,11.12|
Show InChI InChI=1S/C24H24N4O5/c1-3-32-24(31)20-21(30)19(12-15-13-27-22-17(15)5-4-8-26-22)33-23(20)28-18-7-6-16(11-14(18)2)25-9-10-29/h4-8,11-13,20,25,29H,3,9-10H2,1-2H3,(H,26,27)/b19-12-,28-23+
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SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123137
PNG
(US8742113, 89)
Show SMILES OCCCOC(=O)C1C(=O)C(OC1=Nc1ccc(F)cc1)=Cc1c[nH]c2ncccc12 |w:21.23,13.14|
Show InChI InChI=1S/C22H18FN3O5/c23-14-4-6-15(7-5-14)26-21-18(22(29)30-10-2-9-27)19(28)17(31-21)11-13-12-25-20-16(13)3-1-8-24-20/h1,3-8,11-12,18,27H,2,9-10H2,(H,24,25)/b17-11-,26-21-
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SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123143
PNG
(US8742113, 157)
Show SMILES CC(C)OC(=O)C1C(OC(=Cc2c[nH]c3ncccc23)C1=O)=Nc1ccc(OCCO)cc1C |w:10.10,22.25|
Show InChI InChI=1S/C25H25N3O6/c1-14(2)33-25(31)21-22(30)20(12-16-13-27-23-18(16)5-4-8-26-23)34-24(21)28-19-7-6-17(11-15(19)3)32-10-9-29/h4-8,11-14,21,29H,9-10H2,1-3H3,(H,26,27)/b20-12-,28-24+
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SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123144
PNG
(US8742113, 173)
Show SMILES COCCOC(=O)C1C(=O)C(OC1=Nc1ccccc1Cl)=Cc1c[nH]c2ncccc12 |w:21.23,13.14|
Show InChI InChI=1S/C22H18ClN3O5/c1-29-9-10-30-22(28)18-19(27)17(11-13-12-25-20-14(13)5-4-8-24-20)31-21(18)26-16-7-3-2-6-15(16)23/h2-8,11-12,18H,9-10H2,1H3,(H,24,25)/b17-11-,26-21-
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SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123145
PNG
(US8742113, 226)
Show SMILES O=C1CC(OC1=Cc1c[nH]c2ncccc12)=NC1CCCCCC1 |w:6.7,16.19|
Show InChI InChI=1S/C19H21N3O2/c23-16-11-18(22-14-6-3-1-2-4-7-14)24-17(16)10-13-12-21-19-15(13)8-5-9-20-19/h5,8-10,12,14H,1-4,6-7,11H2,(H,20,21)/b17-10-,22-18+
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SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123149
PNG
(US8742113, 244)
Show SMILES CCOC(=O)C1=C(OC(=Cc2c[nH]c3ncccc23)C1=O)N1CCc2ccc(OC)cc2C1 |w:9.9,t:5|
Show InChI InChI=1S/C25H23N3O5/c1-3-32-25(30)21-22(29)20(12-16-13-27-23-19(16)5-4-9-26-23)33-24(21)28-10-8-15-6-7-18(31-2)11-17(15)14-28/h4-7,9,11-13H,3,8,10,14H2,1-2H3,(H,26,27)/b20-12-
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SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123138
PNG
(US8742113, 91)
Show SMILES CN(C)CCOC(=O)C1C(OC(=Cc2c[nH]c3ncccc23)C1=O)=Nc1ccc(F)cc1F |w:12.12,24.27|
Show InChI InChI=1S/C23H20F2N4O4/c1-29(2)8-9-32-23(31)19-20(30)18(10-13-12-27-21-15(13)4-3-7-26-21)33-22(19)28-17-6-5-14(24)11-16(17)25/h3-7,10-12,19H,8-9H2,1-2H3,(H,26,27)/b18-10-,28-22-
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SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123134
PNG
(US8742113, 68)
Show SMILES CCOC(=O)C1C(OC(=Cc2c[nH]c3ncccc23)C1=O)=Nc1ccc2c[nH]nc2c1 |w:9.9,21.24|
Show InChI InChI=1S/C22H17N5O4/c1-2-30-22(29)18-19(28)17(8-13-10-24-20-15(13)4-3-7-23-20)31-21(18)26-14-6-5-12-11-25-27-16(12)9-14/h3-11,18H,2H2,1H3,(H,23,24)(H,25,27)/b17-8-,26-21?
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SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123139
PNG
(US8742113, 102)
Show SMILES CCOC(=O)C1=C(OC(=Cc2c[nH]c3ncccc23)C1=O)N1CCc2ccccc2C1 |w:9.9,t:5|
Show InChI InChI=1S/C24H21N3O4/c1-2-30-24(29)20-21(28)19(12-17-13-26-22-18(17)8-5-10-25-22)31-23(20)27-11-9-15-6-3-4-7-16(15)14-27/h3-8,10,12-13H,2,9,11,14H2,1H3,(H,25,26)/b19-12-
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SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123136
PNG
(US8742113, 81)
Show SMILES CCOC(=O)C1C(C=C(Cc2c[nH]c3ncccc23)C1=O)=Nc1ccc(OCCO)cc1F |w:21.24,t:7|
Show InChI InChI=1S/C24H22FN3O5/c1-2-32-24(31)21-20(28-19-6-5-16(12-18(19)25)33-9-8-29)11-14(22(21)30)10-15-13-27-23-17(15)4-3-7-26-23/h3-7,11-13,21,29H,2,8-10H2,1H3,(H,26,27)/b28-20-
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SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123133
PNG
(US8742113, 63)
Show SMILES CCOC(=O)C1=C(OC(=Cc2c[nH]c3ncccc23)C1=O)N1CCCCCC1 |w:9.9,t:5|
Show InChI InChI=1S/C21H23N3O4/c1-2-27-21(26)17-18(25)16(28-20(17)24-10-5-3-4-6-11-24)12-14-13-23-19-15(14)8-7-9-22-19/h7-9,12-13H,2-6,10-11H2,1H3,(H,22,23)/b16-12-
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SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123150
PNG
(US8742113, 245)
Show SMILES CC(C)OC(=O)C1C(OC(=Cc2c[nH]c3ncccc23)C1=O)=NN1CCOCC1 |w:10.10,22.25|
Show InChI InChI=1S/C20H22N4O5/c1-12(2)28-20(26)16-17(25)15(29-19(16)23-24-6-8-27-9-7-24)10-13-11-22-18-14(13)4-3-5-21-18/h3-5,10-12,16H,6-9H2,1-2H3,(H,21,22)/b15-10-,23-19-
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n/an/a 8n/an/an/an/a7.5n/a



SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123151
PNG
(US8742113, 246)
Show SMILES CCOC(=O)C1C(OC(=Cc2c[nH]c3ncccc23)C1=O)=NN1CCN(CC(F)(F)F)CC1 |w:9.9,21.24|
Show InChI InChI=1S/C21H22F3N5O4/c1-2-32-20(31)16-17(30)15(10-13-11-26-18-14(13)4-3-5-25-18)33-19(16)27-29-8-6-28(7-9-29)12-21(22,23)24/h3-5,10-11,16H,2,6-9,12H2,1H3,(H,25,26)/b15-10-,27-19+
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SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123141
PNG
(US8742113, 129)
Show SMILES CCOC(=O)C1C(OC(=Cc2c[nH]c3ncccc23)C1=O)=Nc1ccc(CN(C)C)cc1C |w:9.9,21.24|
Show InChI InChI=1S/C25H26N4O4/c1-5-32-25(31)21-22(30)20(12-17-13-27-23-18(17)7-6-10-26-23)33-24(21)28-19-9-8-16(11-15(19)2)14-29(3)4/h6-13,21H,5,14H2,1-4H3,(H,26,27)/b20-12-,28-24+
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n/an/a 9n/an/an/an/a7.5n/a



SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123132
PNG
(US8742113, 22)
Show SMILES OC(=O)C1C(OC(=Cc2c[nH]c3ncccc23)C1=O)=Nc1ccccc1 |w:7.7,19.22|
Show InChI InChI=1S/C19H13N3O4/c23-16-14(9-11-10-21-17-13(11)7-4-8-20-17)26-18(15(16)19(24)25)22-12-5-2-1-3-6-12/h1-10,15H,(H,20,21)(H,24,25)/b14-9-,22-18-
PDB

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US Patent
n/an/a 10n/an/an/an/a7.5n/a



SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
Cell division cycle 7-related protein kinase


(Homo sapiens (Human))		BDBM123135
PNG
(US8742113, 78)
Show SMILES CCOC(=O)C1=C(OC(=Cc2c[nH]c3ncccc23)C1=O)N1CCC(C)CC1 |w:9.9,t:5|
Show InChI InChI=1S/C21H23N3O4/c1-3-27-21(26)17-18(25)16(28-20(17)24-9-6-13(2)7-10-24)11-14-12-23-19-15(14)5-4-8-22-19/h4-5,8,11-13H,3,6-7,9-10H2,1-2H3,(H,22,23)/b16-11-
PDB

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US Patent
n/an/a 11n/an/an/an/a7.5n/a



SBI Biotech Co., Ltd.; Carna Biosciences, Inc.

US Patent


Assay Description
Measurement of kinase activity was carried out using an MSA assay kit (QuickScout Screening Assist Kit, Carna Biosciences, Inc.). Assay buffer (20 mM...

US Patent US8742113 (2014)


BindingDB Entry DOI: 10.7270/Q2B856S5
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%