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Found 64 hits from Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.   
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
b-raf


()
BDBM197677
PNG
(US9216981, 5 | US9550781, 1)
Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(Nc2ncccc2-c2ncnc3[nH]cnc23)c1F
Show InChI InChI=1S/C19H17F2N7O2S/c1-2-8-31(29,30)28-13-6-5-12(20)16(14(13)21)27-18-11(4-3-7-22-18)15-17-19(25-9-23-15)26-10-24-17/h3-7,9-10,28H,2,8H2,1H3,(H,22,27)(H,23,24,25,26)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
b-raf


()
BDBM197689
PNG
(US9216981, 17 | US9550781, 24)
Show SMILES Fc1ccc(NS(=O)(=O)c2ccsc2)c(F)c1Nc1ncccc1-c1ncnc2[nH]cnc12
Show InChI InChI=1S/C20H13F2N7O2S2/c21-13-3-4-14(29-33(30,31)11-5-7-32-8-11)15(22)17(13)28-19-12(2-1-6-23-19)16-18-20(26-9-24-16)27-10-25-18/h1-10,29H,(H,23,28)(H,24,25,26,27)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204731
PNG
((s)-6-(2-fluoro-4-iodophenylamino)-n-(2-hydroxypro...)
Show SMILES C[C@H](O)CONC(=O)c1c(Nc2ccc(I)cc2F)n(C)c(=O)c2ccoc12
Show InChI InChI=1S/C18H17FIN3O5/c1-9(24)8-28-22-17(25)14-15-11(5-6-27-15)18(26)23(2)16(14)21-13-4-3-10(20)7-12(13)19/h3-7,9,21,24H,8H2,1-2H3,(H,22,25)/t9-/m0/s1
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204735
PNG
(US9540396, 7 | n-(cyclopropylmethoxy)-6-(2-fluoro-...)
Show SMILES Cn1c(Nc2ccc(I)cc2F)c(C(=O)NOCC2CC2)c2occc2c1=O
Show InChI InChI=1S/C19H17FIN3O4/c1-24-17(22-14-5-4-11(21)8-13(14)20)15(16-12(19(24)26)6-7-27-16)18(25)23-28-9-10-2-3-10/h4-8,10,22H,2-3,9H2,1H3,(H,23,25)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
b-raf


()
BDBM205013
PNG
(US9550781, 10 | n-(3-(3-(9h-purin-6-yl)pyridin-2-y...)
Show SMILES FCCCS(=O)(=O)Nc1ccc(F)c(Nc2ncccc2-c2ncnc3[nH]cnc23)c1F
Show InChI InChI=1S/C19H16F3N7O2S/c20-6-2-8-32(30,31)29-13-5-4-12(21)16(14(13)22)28-18-11(3-1-7-23-18)15-17-19(26-9-24-15)27-10-25-17/h1,3-5,7,9-10,29H,2,6,8H2,(H,23,28)(H,24,25,26,27)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204616
PNG
(6-(2-fluoro-4-iodophenylamino)-n-(2-hydroxyethoxy)...)
Show SMILES Cn1c(Nc2ccc(I)cc2F)c(C(=O)NOCCO)c2occc2c1=O
Show InChI InChI=1S/C17H15FIN3O5/c1-22-15(20-12-3-2-9(19)8-11(12)18)13(16(24)21-27-7-5-23)14-10(17(22)25)4-6-26-14/h2-4,6,8,20,23H,5,7H2,1H3,(H,21,24)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204736
PNG
(6-(2-fluoro-4-iodophenylamino)-n-(1-hydroxy-2-meth...)
Show SMILES Cn1c(Nc2ccc(I)cc2F)c(C(=O)NOC(C)(C)CO)c2occc2c1=O
Show InChI InChI=1S/C19H19FIN3O5/c1-19(2,9-25)29-23-17(26)14-15-11(6-7-28-15)18(27)24(3)16(14)22-13-5-4-10(21)8-12(13)20/h4-8,22,25H,9H2,1-3H3,(H,23,26)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
b-raf


()
BDBM205040
PNG
(US9550781, 27 | n-(3-(2-(9h-purin-6-yl)phenylamino...)
Show SMILES CCCS(=O)(=O)Nc1ccc(C)c(Nc2ccccc2-c2ncnc3[nH]cnc23)c1
Show InChI InChI=1S/C21H22N6O2S/c1-3-10-30(28,29)27-15-9-8-14(2)18(11-15)26-17-7-5-4-6-16(17)19-20-21(24-12-22-19)25-13-23-20/h4-9,11-13,26-27H,3,10H2,1-2H3,(H,22,23,24,25)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
b-raf


()
BDBM205012
PNG
(US9550781, 9 | n-(3-(3-(9h-purin-6-yl)pyridin-2-yl...)
Show SMILES FCCCS(=O)(=O)Nc1ccc(Cl)c(Nc2ncccc2-c2ncnc3[nH]cnc23)c1F
Show InChI InChI=1S/C19H16ClF2N7O2S/c20-12-4-5-13(29-32(30,31)8-2-6-21)14(22)16(12)28-18-11(3-1-7-23-18)15-17-19(26-9-24-15)27-10-25-17/h1,3-5,7,9-10,29H,2,6,8H2,(H,23,28)(H,24,25,26,27)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
b-raf


()
BDBM205011
PNG
(US9550781, 8 | n-(3-(3-(9h-purin-6-yl)pyridin-2-yl...)
Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(Nc2ncccc2-c2ncnc3[nH]cnc23)c1Cl
Show InChI InChI=1S/C19H17ClFN7O2S/c1-2-8-31(29,30)28-13-6-5-12(21)16(14(13)20)27-18-11(4-3-7-22-18)15-17-19(25-9-23-15)26-10-24-17/h3-7,9-10,28H,2,8H2,1H3,(H,22,27)(H,23,24,25,26)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204747
PNG
(6-(2-chloro-4-iodophenylamino)-n-(2-hydroxyethoxy)...)
Show SMILES Cn1c(Nc2ccc(I)cc2Cl)c(C(=O)NOCCO)c2occc2c1=O
Show InChI InChI=1S/C17H15ClIN3O5/c1-22-15(20-12-3-2-9(19)8-11(12)18)13(16(24)21-27-7-5-23)14-10(17(22)25)4-6-26-14/h2-4,6,8,20,23H,5,7H2,1H3,(H,21,24)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204784
PNG
(6-(2-fluoro-4-iodophenylamino)-7-(3-hydroxy-3-(pip...)
Show SMILES CSc1nc2c(C(=O)NOCCO)c(Nc3ccc(I)cc3Cl)n(C)c(=O)c2s1
Show InChI InChI=1S/C17H16ClIN4O4S2/c1-23-14(20-10-4-3-8(19)7-9(10)18)11(15(25)22-27-6-5-24)12-13(16(23)26)29-17(21-12)28-2/h3-4,7,20,24H,5-6H2,1-2H3,(H,22,25)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
b-raf


()
BDBM205007
PNG
(US9550781, 4 | n-(3-(3-(9h-purin-6-yl)pyridin-2-yl...)
Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(Nc2ncccc2-c2ncnc3[nH]cnc23)c1
Show InChI InChI=1S/C19H18FN7O2S/c1-2-8-30(28,29)27-12-5-6-14(20)15(9-12)26-18-13(4-3-7-21-18)16-17-19(24-10-22-16)25-11-23-17/h3-7,9-11,27H,2,8H2,1H3,(H,21,26)(H,22,23,24,25)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
b-raf


()
BDBM197706
PNG
(US9216981, 35 | US9550781, 15)
Show SMILES Fc1ccc(NS(=O)(=O)c2ccccc2)c(F)c1Nc1ncccc1-c1ncnc2[nH]cnc12
Show InChI InChI=1S/C22H15F2N7O2S/c23-15-8-9-16(31-34(32,33)13-5-2-1-3-6-13)17(24)19(15)30-21-14(7-4-10-25-21)18-20-22(28-11-26-18)29-12-27-20/h1-12,31H,(H,25,30)(H,26,27,28,29)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
b-raf


()
BDBM205008
PNG
(US9550781, 5 | n-(3-(3-(9h-purin-6-yl)pyridin-2-yl...)
Show SMILES CCCS(=O)(=O)Nc1ccc(Cl)c(Nc2ncccc2-c2ncnc3[nH]cnc23)c1
Show InChI InChI=1S/C19H18ClN7O2S/c1-2-8-30(28,29)27-12-5-6-14(20)15(9-12)26-18-13(4-3-7-21-18)16-17-19(24-10-22-16)25-11-23-17/h3-7,9-11,27H,2,8H2,1H3,(H,21,26)(H,22,23,24,25)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
b-raf


()
BDBM205021
PNG
(US9550781, 18 | n-(3-(3-(9h-purin-6-yl)pyridin-2-y...)
Show SMILES Fc1ccc(NS(=O)(=O)CCC(F)(F)F)c(F)c1Nc1ncccc1-c1ncnc2[nH]cnc12
Show InChI InChI=1S/C19H14F5N7O2S/c20-11-3-4-12(31-34(32,33)7-5-19(22,23)24)13(21)15(11)30-17-10(2-1-6-25-17)14-16-18(28-8-26-14)29-9-27-16/h1-4,6,8-9,31H,5,7H2,(H,25,30)(H,26,27,28,29)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
b-raf


()
BDBM50165873
PNG
(CHEMBL3800014 | US9550781, 19)
Show SMILES Fc1ccc(NS(=O)(=O)CC(F)(F)F)c(F)c1Nc1ncccc1-c1ncnc2[nH]cnc12
Show InChI InChI=1S/C18H12F5N7O2S/c19-10-3-4-11(30-33(31,32)6-18(21,22)23)12(20)14(10)29-16-9(2-1-5-24-16)13-15-17(27-7-25-13)28-8-26-15/h1-5,7-8,30H,6H2,(H,24,29)(H,25,26,27,28)
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n/an/a<100n/an/an/an/an/an/a



Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
b-raf


()
BDBM205009
PNG
(US9550781, 6 | n-(3-(3-(9h-purin-6-yl)pyridin-2-yl...)
Show SMILES CCCS(=O)(=O)Nc1ccc(C)c(Nc2ncccc2-c2ncnc3[nH]cnc23)c1
Show InChI InChI=1S/C20H21N7O2S/c1-3-9-30(28,29)27-14-7-6-13(2)16(10-14)26-19-15(5-4-8-21-19)17-18-20(24-11-22-17)25-12-23-18/h4-8,10-12,27H,3,9H2,1-2H3,(H,21,26)(H,22,23,24,25)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
b-raf


()
BDBM205010
PNG
(US9550781, 7 | n-(3-(3-(9h-purin-6-yl)pyridin-2-yl...)
Show SMILES CCCS(=O)(=O)Nc1ccc(Cl)c(Nc2ncccc2-c2ncnc3[nH]cnc23)c1F
Show InChI InChI=1S/C19H17ClFN7O2S/c1-2-8-31(29,30)28-13-6-5-12(20)16(14(13)21)27-18-11(4-3-7-22-18)15-17-19(25-9-23-15)26-10-24-17/h3-7,9-10,28H,2,8H2,1H3,(H,22,27)(H,23,24,25,26)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204738
PNG
((s)-6-(2-fluoro-4-iodophenylamino)-n-(2-hydroxybut...)
Show SMILES CC[C@H](O)CONC(=O)c1c(Nc2ccc(I)cc2F)n(C)c(=O)c2ccoc12
Show InChI InChI=1S/C19H19FIN3O5/c1-3-11(25)9-29-23-18(26)15-16-12(6-7-28-16)19(27)24(2)17(15)22-14-5-4-10(21)8-13(14)20/h4-8,11,22,25H,3,9H2,1-2H3,(H,23,26)/t11-/m0/s1
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204737
PNG
((r)żn-(2,3-dihydroxypropoxy)-6-(2-fluoro-4-iodophe...)
Show SMILES Cn1c(Nc2ccc(I)cc2F)c(C(=O)NOC[C@H](O)CO)c2occc2c1=O
Show InChI InChI=1S/C18H17FIN3O6/c1-23-16(21-13-3-2-9(20)6-12(13)19)14(15-11(18(23)27)4-5-28-15)17(26)22-29-8-10(25)7-24/h2-6,10,21,24-25H,7-8H2,1H3,(H,22,26)/t10-/m1/s1
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204732
PNG
((s)-6-(2-fluoro-4-iodophenylamino)-n-(1-hydroxypro...)
Show SMILES C[C@@H](CO)ONC(=O)c1c(Nc2ccc(I)cc2F)n(C)c(=O)c2ccoc12
Show InChI InChI=1S/C18H17FIN3O5/c1-9(8-24)28-22-17(25)14-15-11(5-6-27-15)18(26)23(2)16(14)21-13-4-3-10(20)7-12(13)19/h3-7,9,21,24H,8H2,1-2H3,(H,22,25)/t9-/m0/s1
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204734
PNG
(6-(2-fluoro-4-iodophenylamino)-n-(2-methoxyethoxy)...)
Show SMILES COCCONC(=O)c1c(Nc2ccc(I)cc2F)n(C)c(=O)c2ccoc12
Show InChI InChI=1S/C18H17FIN3O5/c1-23-16(21-13-4-3-10(20)9-12(13)19)14(17(24)22-28-8-7-26-2)15-11(18(23)25)5-6-27-15/h3-6,9,21H,7-8H2,1-2H3,(H,22,24)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204729
PNG
(6-(2-fluoro-4-iodophenylamino)-n-(2-hydroxyethoxy)...)
Show SMILES Cc1cc2c(o1)c(C(=O)NOCCO)c(Nc1ccc(I)cc1F)n(C)c2=O
Show InChI InChI=1S/C18H17FIN3O5/c1-9-7-11-15(28-9)14(17(25)22-27-6-5-24)16(23(2)18(11)26)21-13-4-3-10(20)8-12(13)19/h3-4,7-8,21,24H,5-6H2,1-2H3,(H,22,25)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
b-raf


()
BDBM205038
PNG
(US9550781, 26 | n-(3-(3-(7h-pyrrolo[2,3-d]pyrimidi...)
Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(Nc2ncccc2-c2ncnc3[nH]ccc23)c1F
Show InChI InChI=1S/C20H18F2N6O2S/c1-2-10-31(29,30)28-15-6-5-14(21)18(16(15)22)27-20-12(4-3-8-23-20)17-13-7-9-24-19(13)26-11-25-17/h3-9,11,28H,2,10H2,1H3,(H,23,27)(H,24,25,26)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
b-raf


()
BDBM205035
PNG
(US9550781, 25 | n-(3-(3-(1h-pyrazolo[3,4-d]pyrimid...)
Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(Nc2ncccc2-c2ncnc3[nH]ncc23)c1F
Show InChI InChI=1S/C19H17F2N7O2S/c1-2-8-31(29,30)28-14-6-5-13(20)17(15(14)21)26-18-11(4-3-7-22-18)16-12-9-25-27-19(12)24-10-23-16/h3-7,9-10,28H,2,8H2,1H3,(H,22,26)(H,23,24,25,27)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
b-raf


()
BDBM205024
PNG
(US9550781, 21 | n-(3-(3-(9h-purin-6-yl)pyridin-2-y...)
Show SMILES Fc1ccc(NS(=O)(=O)C2CC2c2ccccc2)c(F)c1Nc1ncccc1-c1ncnc2[nH]cnc12
Show InChI InChI=1S/C25H19F2N7O2S/c26-17-8-9-18(34-37(35,36)19-11-16(19)14-5-2-1-3-6-14)20(27)22(17)33-24-15(7-4-10-28-24)21-23-25(31-12-29-21)32-13-30-23/h1-10,12-13,16,19,34H,11H2,(H,28,33)(H,29,30,31,32)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
b-raf


()
BDBM205023
PNG
(US9550781, 20 | n-(3-(3-(9h-purin-6-yl)pyridin-2-y...)
Show SMILES Fc1ccc(NS(=O)(=O)C=C)c(F)c1Nc1ncccc1-c1ncnc2[nH]cnc12
Show InChI InChI=1S/C18H13F2N7O2S/c1-2-30(28,29)27-12-6-5-11(19)15(13(12)20)26-17-10(4-3-7-21-17)14-16-18(24-8-22-14)25-9-23-16/h2-9,27H,1H2,(H,21,26)(H,22,23,24,25)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
b-raf


()
BDBM205020
PNG
(US9550781, 17 | n-(3-(3-(9h-purin-6-yl)pyridin-2-y...)
Show SMILES Fc1ccc(NS(=O)(=O)c2ccc(Cl)cc2)c(F)c1Nc1ncccc1-c1ncnc2[nH]cnc12
Show InChI InChI=1S/C22H14ClF2N7O2S/c23-12-3-5-13(6-4-12)35(33,34)32-16-8-7-15(24)19(17(16)25)31-21-14(2-1-9-26-21)18-20-22(29-10-27-18)30-11-28-20/h1-11,32H,(H,26,31)(H,27,28,29,30)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
b-raf


()
BDBM205017
PNG
(US9550781, 14 | n-(3-(3-(9h-purin-6-yl)pyridin-2-y...)
Show SMILES Fc1ccc(cc1F)S(=O)(=O)Nc1ccc(F)c(Nc2ncccc2-c2ncnc3[nH]cnc23)c1F
Show InChI InChI=1S/C22H13F4N7O2S/c23-13-4-3-11(8-15(13)25)36(34,35)33-16-6-5-14(24)19(17(16)26)32-21-12(2-1-7-27-21)18-20-22(30-9-28-18)31-10-29-20/h1-10,33H,(H,27,32)(H,28,29,30,31)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
b-raf


()
BDBM50165871
PNG
(CHEMBL3798635 | US9550781, 13)
Show SMILES CS(=O)(=O)Nc1ccc(F)c(Nc2ncccc2-c2ncnc3[nH]cnc23)c1F
Show InChI InChI=1S/C17H13F2N7O2S/c1-29(27,28)26-11-5-4-10(18)14(12(11)19)25-16-9(3-2-6-20-16)13-15-17(23-7-21-13)24-8-22-15/h2-8,26H,1H3,(H,20,25)(H,21,22,23,24)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
b-raf


()
BDBM205014
PNG
(US9550781, 11 | n-(3-(3-(9h-purin-6-yl)pyridin-2-y...)
Show SMILES Fc1ccc(NS(=O)(=O)CCl)c(F)c1Nc1ncccc1-c1ncnc2[nH]cnc12
Show InChI InChI=1S/C17H12ClF2N7O2S/c18-6-30(28,29)27-11-4-3-10(19)14(12(11)20)26-16-9(2-1-5-21-16)13-15-17(24-7-22-13)25-8-23-15/h1-5,7-8,27H,6H2,(H,21,26)(H,22,23,24,25)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
b-raf


()
BDBM205005
PNG
(US9550781, 3 | n-(2,4-difluoro-3-(3-(8-methyl-9h-p...)
Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(Nc2ncccc2-c2ncnc3[nH]c(C)nc23)c1F
Show InChI InChI=1S/C20H19F2N7O2S/c1-3-9-32(30,31)29-14-7-6-13(21)17(15(14)22)28-19-12(5-4-8-23-19)16-18-20(25-10-24-16)27-11(2)26-18/h4-8,10,29H,3,9H2,1-2H3,(H,23,28)(H,24,25,26,27)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204782
PNG
(6-(2-chloro-4-iodophenylamino)-n-(2-hydroxyethoxy)...)
Show SMILES Cc1nc2c(C(=O)NOCCO)c(Nc3ccc(I)cc3F)n(C)c(=O)c2s1
Show InChI InChI=1S/C17H16FIN4O4S/c1-8-20-13-12(16(25)22-27-6-5-24)15(23(2)17(26)14(13)28-8)21-11-4-3-9(19)7-10(11)18/h3-4,7,21,24H,5-6H2,1-2H3,(H,22,25)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204781
PNG
(6-(2-chloro-4-iodophenylamino)-n-(3-hydroxypropyl)...)
Show SMILES Cc1coc2c(C(=O)NOCCO)c(Nc3ccc(I)cc3Cl)n(C)c(=O)c12
Show InChI InChI=1S/C18H17ClIN3O5/c1-9-8-27-15-13(9)18(26)23(2)16(14(15)17(25)22-28-6-5-24)21-12-4-3-10(20)7-11(12)19/h3-4,7-8,21,24H,5-6H2,1-2H3,(H,22,25)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204772
PNG
(6-(2-fluoro-4-iodophenylamino)-n-(2-hydroxyethoxy)...)
Show SMILES CSc1nc2c(C(=O)NOCCO)c(Nc3ccc(I)cc3F)n(C)c(=O)c2s1
Show InChI InChI=1S/C17H16FIN4O4S2/c1-23-14(20-10-4-3-8(19)7-9(10)18)11(15(25)22-27-6-5-24)12-13(16(23)26)29-17(21-12)28-2/h3-4,7,20,24H,5-6H2,1-2H3,(H,22,25)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204771
PNG
(2-amino-6-(2-fluoro-4-iodophenylamino)-n-(2-hydrox...)
Show SMILES CNc1nc2c(C(=O)NOCCO)c(Nc3ccc(I)cc3F)n(C)c(=O)c2s1
Show InChI InChI=1S/C17H17FIN5O4S/c1-20-17-22-12-11(15(26)23-28-6-5-25)14(24(2)16(27)13(12)29-17)21-10-4-3-8(19)7-9(10)18/h3-4,7,21,25H,5-6H2,1-2H3,(H,20,22)(H,23,26)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204770
PNG
(6-(2-fluoro-4-iodophenylamino)-n-(2-hydroxyacetyl)...)
Show SMILES Cn1c(Nc2ccc(I)cc2F)c(C(=O)NOCCO)c2nc(N)sc2c1=O
Show InChI InChI=1S/C16H15FIN5O4S/c1-23-13(20-9-3-2-7(18)6-8(9)17)10(14(25)22-27-5-4-24)11-12(15(23)26)28-16(19)21-11/h2-3,6,20,24H,4-5H2,1H3,(H2,19,21)(H,22,25)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204768
PNG
(2-((dimethylamino)methyl)-6-(2-fluoro-4-iodophenyl...)
Show SMILES Cn1c(Nc2ccc(I)cc2F)c(C(=O)NOCCO)c2oc(CN3CCOCC3)cc2c1=O
Show InChI InChI=1S/C22H24FIN4O6/c1-27-20(25-17-3-2-13(24)10-16(17)23)18(21(30)26-33-9-6-29)19-15(22(27)31)11-14(34-19)12-28-4-7-32-8-5-28/h2-3,10-11,25,29H,4-9,12H2,1H3,(H,26,30)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204765
PNG
((r)żn-(2,3-dihydroxypropoxy)-6-(2-fluoro-4-iodophe...)
Show SMILES CN(C)Cc1cc2c(o1)c(C(=O)NOCCO)c(Nc1ccc(I)cc1F)n(C)c2=O
Show InChI InChI=1S/C20H22FIN4O5/c1-25(2)10-12-9-13-17(31-12)16(19(28)24-30-7-6-27)18(26(3)20(13)29)23-15-5-4-11(22)8-14(15)21/h4-5,8-9,23,27H,6-7,10H2,1-3H3,(H,24,28)
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Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204764
PNG
(6-(2-fluoro-4-iodophenylamino)-n-(2-hydroxyethoxy)...)
Show SMILES Cc1cc2c(o1)c(C(=O)NOC[C@H](O)CO)c(Nc1ccc(I)cc1F)n(C)c2=O
Show InChI InChI=1S/C19H19FIN3O6/c1-9-5-12-16(30-9)15(18(27)23-29-8-11(26)7-25)17(24(2)19(12)28)22-14-4-3-10(21)6-13(14)20/h3-6,11,22,25-26H,7-8H2,1-2H3,(H,23,27)/t11-/m1/s1
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n/an/a<500n/an/an/an/an/an/a



Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204762
PNG
(6-(2-fluoro-4-iodophenylamino)-n-(2-hydroxyethoxy)...)
Show SMILES Cc1coc2c(C(=O)NOCCO)c(Nc3ccc(I)cc3F)n(C)c(=O)c12
Show InChI InChI=1S/C18H17FIN3O5/c1-9-8-27-15-13(9)18(26)23(2)16(14(15)17(25)22-28-6-5-24)21-12-4-3-10(20)7-11(12)19/h3-4,7-8,21,24H,5-6H2,1-2H3,(H,22,25)
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n/an/a<500n/an/an/an/an/an/a



Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204756
PNG
(6-(2-fluoro-4-(methylthio)phenylamino)-n-(2-hydrox...)
Show SMILES CSc1ccc(Nc2c(C(=O)NOCCO)c3occc3c(=O)n2C)c(F)c1
Show InChI InChI=1S/C18H18FN3O5S/c1-22-16(20-13-4-3-10(28-2)9-12(13)19)14(17(24)21-27-8-6-23)15-11(18(22)25)5-7-26-15/h3-5,7,9,20,23H,6,8H2,1-2H3,(H,21,24)
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n/an/a<500n/an/an/an/an/an/a



Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204755
PNG
(6-(2-fluoro-4-iodophenylamino)-n-(2-hydroxyethoxy)...)
Show SMILES Cn1c(Nc2ccc(I)cc2F)c(C(=O)NOCCO)c2sccc2c1=O
Show InChI InChI=1S/C17H15FIN3O4S/c1-22-15(20-12-3-2-9(19)8-11(12)18)13(16(24)21-26-6-5-23)14-10(17(22)25)4-7-27-14/h2-4,7-8,20,23H,5-6H2,1H3,(H,21,24)
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n/an/a<500n/an/an/an/an/an/a



Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204744
PNG
(US9540396, 14 | n-ethoxy-6-(2-fluoro-4-iodophenyla...)
Show SMILES CCONC(=O)c1c(Nc2ccc(I)cc2F)n(C)c(=O)c2ccoc12
Show InChI InChI=1S/C17H15FIN3O4/c1-3-26-21-16(23)13-14-10(6-7-25-14)17(24)22(2)15(13)20-12-5-4-9(19)8-11(12)18/h4-8,20H,3H2,1-2H3,(H,21,23)
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n/an/a<500n/an/an/an/an/an/a



Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204742
PNG
(6-(2-fluoro-4-iodophenylamino)-n-methoxy-5-methyl-...)
Show SMILES CONC(=O)c1c(Nc2ccc(I)cc2F)n(C)c(=O)c2ccoc12
Show InChI InChI=1S/C16H13FIN3O4/c1-21-14(19-11-4-3-8(18)7-10(11)17)12(15(22)20-24-2)13-9(16(21)23)5-6-25-13/h3-7,19H,1-2H3,(H,20,22)
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n/an/a<500n/an/an/an/an/an/a



Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204757
PNG
(6-(2-chloro-4-(methylthio)phenylamino)-n-(2-hydrox...)
Show SMILES CSc1ccc(Nc2c(C(=O)NOCCO)c3occc3c(=O)n2C)c(Cl)c1
Show InChI InChI=1S/C18H18ClN3O5S/c1-22-16(20-13-4-3-10(28-2)9-12(13)19)14(17(24)21-27-8-6-23)15-11(18(22)25)5-7-26-15/h3-5,7,9,20,23H,6,8H2,1-2H3,(H,21,24)
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n/an/a<1.00E+3n/an/an/an/an/an/a



Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (human))
BDBM204758
PNG
(6-(2-fluoro-4-iodophenylamino)-n-(2-hydroxyethoxy)...)
Show SMILES Cc1nc2c(o1)c(C(=O)NOCCO)c(Nc1ccc(I)cc1F)n(C)c2=O
Show InChI InChI=1S/C17H16FIN4O5/c1-8-20-13-14(28-8)12(16(25)22-27-6-5-24)15(23(2)17(13)26)21-11-4-3-9(19)7-10(11)18/h3-4,7,21,24H,5-6H2,1-2H3,(H,22,25)
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n/an/a<1.00E+3n/an/an/an/an/an/a



Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
Compounds were diluted from DMSO stocks into 1× buffer (20 mM MOPS, PH 7.4, 5 mM MgCl2, 0.5 mM MnCl2, 100 uM Sodium Orthovanadate, 0.01% Triton X-100...


US Patent US9540396 (2017)


BindingDB Entry DOI: 10.7270/Q2GT5KBN
More data for this
Ligand-Target Pair
b-raf


()
BDBM205042
PNG
(US9550781, 28 | n-(3-(2-(9h-purin-6-yl)phenylamino...)
Show SMILES CCCS(=O)(=O)Nc1ccc(F)c(Nc2ccccc2-c2ncnc3[nH]cnc23)c1F
Show InChI InChI=1S/C20H18F2N6O2S/c1-2-9-31(29,30)28-15-8-7-13(21)18(16(15)22)27-14-6-4-3-5-12(14)17-19-20(25-10-23-17)26-11-24-19/h3-8,10-11,27-28H,2,9H2,1H3,(H,23,24,25,26)
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n/an/a<1.00E+3n/an/an/an/an/an/a



Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
b-raf


()
BDBM50165865
PNG
(CHEMBL3798423 | US9550781, 23)
Show SMILES Fc1ccc(cc1)S(=O)(=O)Nc1ccc(F)c(Nc2ncccc2-c2ncnc3[nH]cnc23)c1F
Show InChI InChI=1S/C22H14F3N7O2S/c23-12-3-5-13(6-4-12)35(33,34)32-16-8-7-15(24)19(17(16)25)31-21-14(2-1-9-26-21)18-20-22(29-10-27-18)30-11-28-20/h1-11,32H,(H,26,31)(H,27,28,29,30)
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n/an/a<1.00E+3n/an/an/an/an/an/a



Centaurus Biopharma Co., Ltd.; Chia Tai Tianqing Pharmaceutical Group Co., Ltd.

US Patent


Assay Description
In vitro B-RAF Kinase Assay. To determine iIn vitro activities of recombinant B-RAF enzyme, a Homogeneous Time-Resolved Fluorescence (HTRF) assay was...


US Patent US9550781 (2017)

More data for this
Ligand-Target Pair
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