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Patent code US9315500

Compile Data Set for Download or QSAR
Found 26 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
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222932
PNG
(US9315500, 2.2)
Show SMILES Cn1ccc2c(Nc3nc(N[C@@H]4CCCC[C@@H]4N)cc4cn[nH]c(=O)c34)cccc12
Show InChI InChI=1S/C22H25N7O/c1-29-10-9-14-16(7-4-8-18(14)29)26-21-20-13(12-24-28-22(20)30)11-19(27-21)25-17-6-3-2-5-15(17)23/h4,7-12,15,17H,2-3,5-6,23H2,1H3,(H,28,30)(H2,25,26,27)/t15-,17+/m0/s1
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n/an/a 0.600n/an/an/an/an/an/a



NOVARTIS AG

US Patent


Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222933
PNG
(US9315500, 2.3)
Show SMILES Cn1cc2c(Nc3nc(N[C@@H]4CCCC[C@@H]4N)cc4cn[nH]c(=O)c34)cccc2n1
Show InChI InChI=1S/C21H24N8O/c1-29-11-13-15(7-4-8-16(13)28-29)25-20-19-12(10-23-27-21(19)30)9-18(26-20)24-17-6-3-2-5-14(17)22/h4,7-11,14,17H,2-3,5-6,22H2,1H3,(H,27,30)(H2,24,25,26)/t14-,17+/m0/s1
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US Patent


Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222934
PNG
(US9315500, 2.4)
Show SMILES Cc1c[nH]c2c(Nc3nc(N[C@@H]4CCCC[C@@H]4N)cc4cn[nH]c(=O)c34)cc(F)cc12
Show InChI InChI=1S/C22H24FN7O/c1-11-9-25-20-14(11)7-13(23)8-17(20)28-21-19-12(10-26-30-22(19)31)6-18(29-21)27-16-5-3-2-4-15(16)24/h6-10,15-16,25H,2-5,24H2,1H3,(H,30,31)(H2,27,28,29)/t15-,16+/m0/s1
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Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222931
PNG
(US9315500, 2.1)
Show SMILES Cc1c[nH]c2c(Nc3nc(N[C@@H]4CCCC[C@@H]4N)cc4cn[nH]c(=O)c34)cccc12
Show InChI InChI=1S/C22H25N7O/c1-12-10-24-20-14(12)5-4-8-17(20)27-21-19-13(11-25-29-22(19)30)9-18(28-21)26-16-7-3-2-6-15(16)23/h4-5,8-11,15-16,24H,2-3,6-7,23H2,1H3,(H,29,30)(H2,26,27,28)/t15-,16+/m0/s1
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Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222935
PNG
(US9315500, 2.5)
Show SMILES N[C@H]1CCCC[C@H]1Nc1cc2cn[nH]c(=O)c2c(Nc2ccc3ncccc3c2)n1
Show InChI InChI=1S/C22H23N7O/c23-16-5-1-2-6-18(16)27-19-11-14-12-25-29-22(30)20(14)21(28-19)26-15-7-8-17-13(10-15)4-3-9-24-17/h3-4,7-12,16,18H,1-2,5-6,23H2,(H,29,30)(H2,26,27,28)/t16-,18+/m0/s1
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Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


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More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222952
PNG
(US9315500, 3.2)
Show SMILES N[C@H]1COCC[C@H]1Nc1cc2cn[nH]c(=O)c2c(Nc2cccc3sccc23)n1
Show InChI InChI=1S/C20H20N6O2S/c21-13-10-28-6-4-15(13)23-17-8-11-9-22-26-20(27)18(11)19(25-17)24-14-2-1-3-16-12(14)5-7-29-16/h1-3,5,7-9,13,15H,4,6,10,21H2,(H,26,27)(H2,23,24,25)/t13-,15+/m0/s1
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Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


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More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222936
PNG
(US9315500, 2.6)
Show SMILES N[C@H]1CCCC[C@H]1Nc1cc2cn[nH]c(=O)c2c(Nc2cccc3occc23)n1
Show InChI InChI=1S/C21H22N6O2/c22-14-4-1-2-5-16(14)24-18-10-12-11-23-27-21(28)19(12)20(26-18)25-15-6-3-7-17-13(15)8-9-29-17/h3,6-11,14,16H,1-2,4-5,22H2,(H,27,28)(H2,24,25,26)/t14-,16+/m0/s1
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Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222953
PNG
(US9315500, 3.3)
Show SMILES Cc1c[nH]c2c(Nc3nc(N[C@@H]4CCOC[C@@H]4N)cc4cn[nH]c(=O)c34)cc(F)cc12
Show InChI InChI=1S/C21H22FN7O2/c1-10-7-24-19-13(10)5-12(22)6-16(19)27-20-18-11(8-25-29-21(18)30)4-17(28-20)26-15-2-3-31-9-14(15)23/h4-8,14-15,24H,2-3,9,23H2,1H3,(H,29,30)(H2,26,27,28)/t14-,15+/m0/s1
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Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222955
PNG
(US9315500, 1.1)
Show SMILES Cc1c[nH]c2c(Nc3nc(N[C@@H]4CCCC[C@@H]4N)c(F)c4cn[nH]c(=O)c34)cc(F)cc12
Show InChI InChI=1S/C22H23F2N7O/c1-10-8-26-19-12(10)6-11(23)7-16(19)29-20-17-13(9-27-31-22(17)32)18(24)21(30-20)28-15-5-3-2-4-14(15)25/h6-9,14-15,26H,2-5,25H2,1H3,(H,31,32)(H2,28,29,30)/t14-,15+/m0/s1
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Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222937
PNG
(US9315500, 2.7)
Show SMILES N[C@H]1CCCC[C@H]1Nc1cc2cn[nH]c(=O)c2c(Nc2cccc3sccc23)n1
Show InChI InChI=1S/C21H22N6OS/c22-14-4-1-2-5-16(14)24-18-10-12-11-23-27-21(28)19(12)20(26-18)25-15-6-3-7-17-13(15)8-9-29-17/h3,6-11,14,16H,1-2,4-5,22H2,(H,27,28)(H2,24,25,26)/t14-,16+/m0/s1
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Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222938
PNG
(US9315500, 2.8)
Show SMILES Cc1ccc2c(Nc3nc(N[C@@H]4CCCC[C@@H]4N)cc4cn[nH]c(=O)c34)cccc2n1
Show InChI InChI=1S/C23H25N7O/c1-13-9-10-15-17(26-13)7-4-8-18(15)28-22-21-14(12-25-30-23(21)31)11-20(29-22)27-19-6-3-2-5-16(19)24/h4,7-12,16,19H,2-3,5-6,24H2,1H3,(H,30,31)(H2,27,28,29)/t16-,19+/m0/s1
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Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222939
PNG
(US9315500, 2.9)
Show SMILES N[C@H]1CCCC[C@H]1Nc1cc2cn[nH]c(=O)c2c(Nc2cccc3[nH]ccc23)n1
Show InChI InChI=1S/C21H23N7O/c22-14-4-1-2-5-17(14)25-18-10-12-11-24-28-21(29)19(12)20(27-18)26-16-7-3-6-15-13(16)8-9-23-15/h3,6-11,14,17,23H,1-2,4-5,22H2,(H,28,29)(H2,25,26,27)/t14-,17+/m0/s1
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Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222940
PNG
(US9315500, 2.10)
Show SMILES N[C@H]1CCCC[C@H]1Nc1cc2cn[nH]c(=O)c2c(Nc2cccc3[nH]ncc23)n1
Show InChI InChI=1S/C20H22N8O/c21-13-4-1-2-5-16(13)24-17-8-11-9-22-28-20(29)18(11)19(26-17)25-14-6-3-7-15-12(14)10-23-27-15/h3,6-10,13,16H,1-2,4-5,21H2,(H,23,27)(H,28,29)(H2,24,25,26)/t13-,16+/m0/s1
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Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222941
PNG
(US9315500, 2.11)
Show SMILES N[C@H]1CCCC[C@H]1Nc1cc2cn[nH]c(=O)c2c(Nc2cnc3ccccc3c2)n1
Show InChI InChI=1S/C22H23N7O/c23-16-6-2-4-8-18(16)27-19-10-14-11-25-29-22(30)20(14)21(28-19)26-15-9-13-5-1-3-7-17(13)24-12-15/h1,3,5,7,9-12,16,18H,2,4,6,8,23H2,(H,29,30)(H2,26,27,28)/t16-,18+/m0/s1
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Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222942
PNG
(US9315500, 2.12)
Show SMILES N[C@H]1CCCC[C@H]1Nc1cc2cn[nH]c(=O)c2c(Nc2cccc3cc[nH]c23)n1
Show InChI InChI=1S/C21H23N7O/c22-14-5-1-2-6-15(14)25-17-10-13-11-24-28-21(29)18(13)20(27-17)26-16-7-3-4-12-8-9-23-19(12)16/h3-4,7-11,14-15,23H,1-2,5-6,22H2,(H,28,29)(H2,25,26,27)/t14-,15+/m0/s1
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Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222943
PNG
(US9315500, 2.13)
Show SMILES Cc1ccc(Nc2nc(N[C@@H]3CCCC[C@@H]3N)cc3cn[nH]c(=O)c23)c2cccnc12
Show InChI InChI=1S/C23H25N7O/c1-13-8-9-17(15-5-4-10-25-21(13)15)28-22-20-14(12-26-30-23(20)31)11-19(29-22)27-18-7-3-2-6-16(18)24/h4-5,8-12,16,18H,2-3,6-7,24H2,1H3,(H,30,31)(H2,27,28,29)/t16-,18+/m0/s1
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Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222944
PNG
(US9315500, 2.14)
Show SMILES N[C@H]1CCCC[C@H]1Nc1cc2cn[nH]c(=O)c2c(Nc2cccc3c(c[nH]c23)C#N)n1
Show InChI InChI=1S/C22H22N8O/c23-9-13-10-25-20-14(13)4-3-7-17(20)28-21-19-12(11-26-30-22(19)31)8-18(29-21)27-16-6-2-1-5-15(16)24/h3-4,7-8,10-11,15-16,25H,1-2,5-6,24H2,(H,30,31)(H2,27,28,29)/t15-,16+/m0/s1
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Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222945
PNG
(US9315500, 2.15)
Show SMILES Cc1ccc(Nc2nc(N[C@@H]3CCCC[C@@H]3N)cc3cn[nH]c(=O)c23)c2cc[nH]c12
Show InChI InChI=1S/C22H25N7O/c1-12-6-7-16(14-8-9-24-20(12)14)27-21-19-13(11-25-29-22(19)30)10-18(28-21)26-17-5-3-2-4-15(17)23/h6-11,15,17,24H,2-5,23H2,1H3,(H,29,30)(H2,26,27,28)/t15-,17+/m0/s1
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Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222951
PNG
(US9315500, 3.1)
Show SMILES Cc1c[nH]c2c(Nc3nc(N[C@@H]4CCOC[C@@H]4N)cc4cn[nH]c(=O)c34)cccc12
Show InChI InChI=1S/C21H23N7O2/c1-11-8-23-19-13(11)3-2-4-16(19)26-20-18-12(9-24-28-21(18)29)7-17(27-20)25-15-5-6-30-10-14(15)22/h2-4,7-9,14-15,23H,5-6,10,22H2,1H3,(H,28,29)(H2,25,26,27)/t14-,15+/m0/s1
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Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222946
PNG
(US9315500, 2.16)
Show SMILES N[C@H]1CCCC[C@H]1Nc1cc2cn[nH]c(=O)c2c(Nc2cccc3ncccc23)n1
Show InChI InChI=1S/C22H23N7O/c23-15-6-1-2-7-18(15)26-19-11-13-12-25-29-22(30)20(13)21(28-19)27-17-9-3-8-16-14(17)5-4-10-24-16/h3-5,8-12,15,18H,1-2,6-7,23H2,(H,29,30)(H2,26,27,28)/t15-,18+/m0/s1
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Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222947
PNG
(US9315500, 2.17)
Show SMILES Cc1cc2c(Nc3nc(N[C@@H]4CCCC[C@@H]4N)cc4cn[nH]c(=O)c34)cccc2[nH]1
Show InChI InChI=1S/C22H25N7O/c1-12-9-14-16(25-12)7-4-8-17(14)27-21-20-13(11-24-29-22(20)30)10-19(28-21)26-18-6-3-2-5-15(18)23/h4,7-11,15,18,25H,2-3,5-6,23H2,1H3,(H,29,30)(H2,26,27,28)/t15-,18+/m0/s1
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Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222948
PNG
(US9315500, 2.18)
Show SMILES N[C@H]1CCCC[C@H]1Nc1cc2cn[nH]c(=O)c2c(Nc2ccc3nccnc3c2)n1
Show InChI InChI=1S/C21H22N8O/c22-14-3-1-2-4-15(14)27-18-9-12-11-25-29-21(30)19(12)20(28-18)26-13-5-6-16-17(10-13)24-8-7-23-16/h5-11,14-15H,1-4,22H2,(H,29,30)(H2,26,27,28)/t14-,15+/m0/s1
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n/an/a 26n/an/an/an/an/an/a



NOVARTIS AG

US Patent


Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


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More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222954
PNG
(US9315500, 3.4)
Show SMILES N[C@H]1COCC[C@H]1Nc1cc2cn[nH]c(=O)c2c(Nc2cccc3cc[nH]c23)n1
Show InChI InChI=1S/C20H21N7O2/c21-13-10-29-7-5-14(13)24-16-8-12-9-23-27-20(28)17(12)19(26-16)25-15-3-1-2-11-4-6-22-18(11)15/h1-4,6,8-9,13-14,22H,5,7,10,21H2,(H,27,28)(H2,24,25,26)/t13-,14+/m0/s1
PDB

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n/an/a 32n/an/an/an/an/an/a



NOVARTIS AG

US Patent


Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222949
PNG
(US9315500, 2.19)
Show SMILES N[C@H]1CCCC[C@H]1Nc1cc2cn[nH]c(=O)c2c(Nc2ccc3cccnc3c2)n1
Show InChI InChI=1S/C22H23N7O/c23-16-5-1-2-6-17(16)27-19-10-14-12-25-29-22(30)20(14)21(28-19)26-15-8-7-13-4-3-9-24-18(13)11-15/h3-4,7-12,16-17H,1-2,5-6,23H2,(H,29,30)(H2,26,27,28)/t16-,17+/m0/s1
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n/an/a 42n/an/an/an/an/an/a



NOVARTIS AG

US Patent


Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222930
PNG
(US9315500, 1.2)
Show SMILES N[C@H]1CCCC[C@H]1Nc1nc(Nc2cccc3ncccc23)c2c(cn[nH]c2=O)c1F
Show InChI InChI=1S/C22H22FN7O/c23-19-13-11-26-30-22(31)18(13)20(29-21(19)28-17-7-2-1-6-14(17)24)27-16-9-3-8-15-12(16)5-4-10-25-15/h3-5,8-11,14,17H,1-2,6-7,24H2,(H,30,31)(H2,27,28,29)/t14-,17+/m0/s1
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n/an/a 44n/an/an/an/an/an/a



NOVARTIS AG

US Patent


Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK


(Homo sapiens (Human))
BDBM222950
PNG
(US9315500, 2.20)
Show SMILES N[C@H]1CCCC[C@H]1Nc1cc2cn[nH]c(=O)c2c(Nc2cccc3cccnc23)n1
Show InChI InChI=1S/C22H23N7O/c23-15-7-1-2-8-16(15)26-18-11-14-12-25-29-22(30)19(14)21(28-18)27-17-9-3-5-13-6-4-10-24-20(13)17/h3-6,9-12,15-16H,1-2,7-8,23H2,(H,29,30)(H2,26,27,28)/t15-,16+/m0/s1
PDB

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AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 45n/an/an/an/an/an/a



NOVARTIS AG

US Patent


Assay Description
All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, as well as four 8...


Citation and Details
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%