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Patent code US10301306

Compile Data Set for Download or QSAR
Found 185 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
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392917
PNG
(US10301306, Example 115)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccc(F)c(F)c2)c(c1)C#N
Show InChI InChI=1S/C26H17F3N4O/c27-19-3-1-17(18(11-19)13-30)14-33-22-7-10-32-26(34)24(22)23(16-2-4-20(28)21(29)12-16)25(33)15-5-8-31-9-6-15/h1-6,8-9,11-12H,7,10,14H2,(H,32,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392936
PNG
(US10301306, Example 134)
Show SMILES OCc1cccc(c1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccncc1
Show InChI InChI=1S/C27H21FN4O2/c28-22-5-4-20(21(13-22)14-29)15-32-23-8-11-31-27(34)25(23)24(19-3-1-2-17(12-19)16-33)26(32)18-6-9-30-10-7-18/h1-7,9-10,12-13,33H,8,11,15-16H2,(H,31,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392944
PNG
(US10301306, Example 142)
Show SMILES Cc1csc(c1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccncc1
Show InChI InChI=1S/C25H19FN4OS/c1-15-10-21(32-14-15)23-22-20(6-9-29-25(22)31)30(24(23)16-4-7-28-8-5-16)13-17-2-3-19(26)11-18(17)12-27/h2-5,7-8,10-11,14H,6,9,13H2,1H3,(H,29,31)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392816
PNG
(5-Fluoro-2-((4-oxo-2-(pyridin-4-yl)-3-(thiophen-2-...)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(-c3cccs3)c2-c2ccncc2)c(c1)C#N
Show InChI InChI=1S/C24H17FN4OS/c25-18-4-3-16(17(12-18)13-26)14-29-19-7-10-28-24(30)21(19)22(20-2-1-11-31-20)23(29)15-5-8-27-9-6-15/h1-6,8-9,11-12H,7,10,14H2,(H,28,30)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392958
PNG
(N-(4-(1-(2-Fluoro-4-(trifluoromethyl)benzyl)-3-(4-...)
Show SMILES CCC(=O)Nc1cc(ccn1)-c1c(-c2ccc(F)cc2)c2c(cc[nH]c2=O)n1Cc1ccc(cc1F)C(F)(F)F
Show InChI InChI=1S/C29H21F5N4O2/c1-2-24(39)37-23-13-17(9-11-35-23)27-25(16-4-7-20(30)8-5-16)26-22(10-12-36-28(26)40)38(27)15-18-3-6-19(14-21(18)31)29(32,33)34/h3-14H,2,15H2,1H3,(H,36,40)(H,35,37,39)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392959
PNG
(1-(2-Fluoro-4-(trifluoromethyl)benzyl)-3-(4-fluoro...)
Show SMILES Fc1ccc(cc1)-c1c(-c2ccncc2)n(Cc2ccc(cc2F)C(F)(F)F)c2cc[nH]c(=O)c12
Show InChI InChI=1S/C26H16F5N3O/c27-19-5-2-15(3-6-19)22-23-21(9-12-33-25(23)35)34(24(22)16-7-10-32-11-8-16)14-17-1-4-18(13-20(17)28)26(29,30)31/h1-13H,14H2,(H,33,35)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392966
PNG
(US10301306, Example 164)
Show SMILES Cc1ccc(s1)-c1c2c(CCNC2=O)n(Cc2ccc(Cl)cc2F)c1-c1ccncc1
Show InChI InChI=1S/C24H19ClFN3OS/c1-14-2-5-20(31-14)22-21-19(8-11-28-24(21)30)29(23(22)15-6-9-27-10-7-15)13-16-3-4-17(25)12-18(16)26/h2-7,9-10,12H,8,11,13H2,1H3,(H,28,30)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392875
PNG
(US10301306, Example 73)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2c(F)cccc2C(F)(F)F)c1-c1ccncc1
Show InChI InChI=1S/C26H18F5N3O/c27-17-6-4-15(5-7-17)22-23-21(10-13-33-25(23)35)34(24(22)16-8-11-32-12-9-16)14-18-19(26(29,30)31)2-1-3-20(18)28/h1-9,11-12H,10,13-14H2,(H,33,35)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392985
PNG
(US10301306, Example 183)
Show SMILES COc1cnccc1-c1c(c2c(CCNC2=O)n1Cc1cc(C)nn1C)-c1ccc(F)cc1
Show InChI InChI=1S/C25H24FN5O2/c1-15-12-18(30(2)29-15)14-31-20-9-11-28-25(32)23(20)22(16-4-6-17(26)7-5-16)24(31)19-8-10-27-13-21(19)33-3/h4-8,10,12-13H,9,11,14H2,1-3H3,(H,28,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392938
PNG
(US10301306, Example 136)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccc(Cl)c(Cl)c2)c(c1)C#N
Show InChI InChI=1S/C26H17Cl2FN4O/c27-20-4-2-16(12-21(20)28)23-24-22(7-10-32-26(24)34)33(25(23)15-5-8-31-9-6-15)14-17-1-3-19(29)11-18(17)13-30/h1-6,8-9,11-12H,7,10,14H2,(H,32,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392939
PNG
(US10301306, Example 137)
Show SMILES Oc1ccccc1-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccncc1
Show InChI InChI=1S/C26H19FN4O2/c27-19-6-5-17(18(13-19)14-28)15-31-21-9-12-30-26(33)24(21)23(20-3-1-2-4-22(20)32)25(31)16-7-10-29-11-8-16/h1-8,10-11,13,32H,9,12,15H2,(H,30,33)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392940
PNG
(US10301306, Example 138)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2cc(Cl)cc(Cl)c2)c(c1)C#N
Show InChI InChI=1S/C26H17Cl2FN4O/c27-19-9-17(10-20(28)12-19)23-24-22(5-8-32-26(24)34)33(25(23)15-3-6-31-7-4-15)14-16-1-2-21(29)11-18(16)13-30/h1-4,6-7,9-12H,5,8,14H2,(H,32,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392943
PNG
(US10301306, Example 141)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(-c3ccoc3)c2-c2ccncc2)c(c1)C#N
Show InChI InChI=1S/C24H17FN4O2/c25-19-2-1-16(18(11-19)12-26)13-29-20-5-9-28-24(30)22(20)21(17-6-10-31-14-17)23(29)15-3-7-27-8-4-15/h1-4,6-8,10-11,14H,5,9,13H2,(H,28,30)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392953
PNG
(US10301306, Example 151)
Show SMILES CC(C)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(cc1F)C(F)(F)F)-c1ccc(F)cc1
Show InChI InChI=1S/C29H25F5N4O/c1-16(2)37-24-13-18(9-11-35-24)27-25(17-4-7-21(30)8-5-17)26-23(10-12-36-28(26)39)38(27)15-19-3-6-20(14-22(19)31)29(32,33)34/h3-9,11,13-14,16H,10,12,15H2,1-2H3,(H,35,37)(H,36,39)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392843
PNG
(US10301306, Example 41)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2cc(F)cc(c2)C(F)(F)F)c1-c1ccncc1
Show InChI InChI=1S/C26H18F5N3O/c27-19-3-1-16(2-4-19)22-23-21(7-10-33-25(23)35)34(24(22)17-5-8-32-9-6-17)14-15-11-18(26(29,30)31)13-20(28)12-15/h1-6,8-9,11-13H,7,10,14H2,(H,33,35)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392925
PNG
(US10301306, Example 123)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2cccc(c2)C(F)(F)F)c(c1)C#N
Show InChI InChI=1S/C27H18F4N4O/c28-21-5-4-18(19(13-21)14-32)15-35-22-8-11-34-26(36)24(22)23(25(35)16-6-9-33-10-7-16)17-2-1-3-20(12-17)27(29,30)31/h1-7,9-10,12-13H,8,11,15H2,(H,34,36)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392929
PNG
(US10301306, Example 127)
Show SMILES Oc1cccc(c1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccncc1
Show InChI InChI=1S/C26H19FN4O2/c27-20-5-4-18(19(12-20)14-28)15-31-22-8-11-30-26(33)24(22)23(17-2-1-3-21(32)13-17)25(31)16-6-9-29-10-7-16/h1-7,9-10,12-13,32H,8,11,15H2,(H,30,33)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392815
PNG
(3-(4-Fluorophenyl)-1-(4-(3-methyl-1,2,4-oxadiazol-...)
Show SMILES Cc1noc(n1)-c1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccc(F)cc2)cc1
Show InChI InChI=1S/C28H22FN5O2/c1-17-32-28(36-33-17)21-4-2-18(3-5-21)16-34-23-12-15-31-27(35)25(23)24(19-6-8-22(29)9-7-19)26(34)20-10-13-30-14-11-20/h2-11,13-14H,12,15-16H2,1H3,(H,31,35)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392829
PNG
(US10301306, Example 27)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccncc1F
Show InChI InChI=1S/C26H17F3N4O/c27-18-4-1-15(2-5-18)23-24-22(8-10-32-26(24)34)33(25(23)20-7-9-31-13-21(20)29)14-16-3-6-19(28)11-17(16)12-30/h1-7,9,11,13H,8,10,14H2,(H,32,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392848
PNG
(US10301306, Example 46)
Show SMILES Cc1cc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccc(F)cc2)ccc1F
Show InChI InChI=1S/C26H21F2N3O/c1-16-14-17(2-7-21(16)28)15-31-22-10-13-30-26(32)24(22)23(18-3-5-20(27)6-4-18)25(31)19-8-11-29-12-9-19/h2-9,11-12,14H,10,13,15H2,1H3,(H,30,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392853
PNG
(US10301306, Example 51)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(cc2F)C#N)c1-c1ccncc1
Show InChI InChI=1S/C26H18F2N4O/c27-20-5-3-17(4-6-20)23-24-22(9-12-31-26(24)33)32(25(23)18-7-10-30-11-8-18)15-19-2-1-16(14-29)13-21(19)28/h1-8,10-11,13H,9,12,15H2,(H,31,33)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392867
PNG
(US10301306, Example 65)
Show SMILES Cc1cc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccc(F)cc2)n(C)n1
Show InChI InChI=1S/C24H22FN5O/c1-15-13-19(29(2)28-15)14-30-20-9-12-27-24(31)22(20)21(16-3-5-18(25)6-4-16)23(30)17-7-10-26-11-8-17/h3-8,10-11,13H,9,12,14H2,1-2H3,(H,27,31)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392868
PNG
(US10301306, Example 66)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccncc2)c1-c1ccncc1
Show InChI InChI=1S/C24H19FN4O/c25-19-3-1-17(2-4-19)21-22-20(9-14-28-24(22)30)29(15-16-5-10-26-11-6-16)23(21)18-7-12-27-13-8-18/h1-8,10-13H,9,14-15H2,(H,28,30)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392880
PNG
(US10301306, Example 78)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(CC2CCCC2)c1-c1ccncc1
Show InChI InChI=1S/C24H24FN3O/c25-19-7-5-17(6-8-19)21-22-20(11-14-27-24(22)29)28(15-16-3-1-2-4-16)23(21)18-9-12-26-13-10-18/h5-10,12-13,16H,1-4,11,14-15H2,(H,27,29)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392902
PNG
(US10301306, Example 100 | US10301306, Example 161)
Show SMILES CC(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(F)cc1C#N)-c1ccc(F)cc1
Show InChI InChI=1S/C28H21F2N5O2/c1-16(36)34-24-13-18(8-10-32-24)27-25(17-2-5-21(29)6-3-17)26-23(9-11-33-28(26)37)35(27)15-19-4-7-22(30)12-20(19)14-31/h2-8,10,12-13H,9,11,15H2,1H3,(H,33,37)(H,32,34,36)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392926
PNG
(US10301306, Example 124)
Show SMILES COc1ccc(cn1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccncc1
Show InChI InChI=1S/C26H20FN5O2/c1-34-22-5-3-17(14-31-22)23-24-21(8-11-30-26(24)33)32(25(23)16-6-9-29-10-7-16)15-18-2-4-20(27)12-19(18)13-28/h2-7,9-10,12,14H,8,11,15H2,1H3,(H,30,33)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392930
PNG
(US10301306, Example 128)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(-c3ccsc3)c2-c2ccncc2)c(c1)C#N
Show InChI InChI=1S/C24H17FN4OS/c25-19-2-1-16(18(11-19)12-26)13-29-20-5-9-28-24(30)22(20)21(17-6-10-31-14-17)23(29)15-3-7-27-8-4-15/h1-4,6-8,10-11,14H,5,9,13H2,(H,28,30)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392942
PNG
(US10301306, Example 140)
Show SMILES COc1cc(ccn1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccncc1
Show InChI InChI=1S/C26H20FN5O2/c1-34-22-13-17(6-10-30-22)23-24-21(7-11-31-26(24)33)32(25(23)16-4-8-29-9-5-16)15-18-2-3-20(27)12-19(18)14-28/h2-6,8-10,12-13H,7,11,15H2,1H3,(H,31,33)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392816
PNG
(5-Fluoro-2-((4-oxo-2-(pyridin-4-yl)-3-(thiophen-2-...)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(-c3cccs3)c2-c2ccncc2)c(c1)C#N
Show InChI InChI=1S/C24H17FN4OS/c25-18-4-3-16(17(12-18)13-26)14-29-19-7-10-28-24(30)21(19)22(20-2-1-11-31-20)23(29)15-5-8-27-9-6-15/h1-6,8-9,11-12H,7,10,14H2,(H,28,30)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392840
PNG
(US10301306, Example 38)
Show SMILES COc1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccc(F)cc2)cc1
Show InChI InChI=1S/C26H22FN3O2/c1-32-21-8-2-17(3-9-21)16-30-22-12-15-29-26(31)24(22)23(18-4-6-20(27)7-5-18)25(30)19-10-13-28-14-11-19/h2-11,13-14H,12,15-16H2,1H3,(H,29,31)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392850
PNG
(US10301306, Example 48)
Show SMILES Cc1nc(no1)-c1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccc(F)cc2)c(F)c1
Show InChI InChI=1S/C28H21F2N5O2/c1-16-33-27(34-37-16)19-2-3-20(22(30)14-19)15-35-23-10-13-32-28(36)25(23)24(17-4-6-21(29)7-5-17)26(35)18-8-11-31-12-9-18/h2-9,11-12,14H,10,13,15H2,1H3,(H,32,36)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392886
PNG
(US10301306, Example 84)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2c(F)cc(cc2F)C#N)c1-c1ccncc1
Show InChI InChI=1S/C26H17F3N4O/c27-18-3-1-16(2-4-18)23-24-22(7-10-32-26(24)34)33(25(23)17-5-8-31-9-6-17)14-19-20(28)11-15(13-30)12-21(19)29/h1-6,8-9,11-12H,7,10,14H2,(H,32,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392955
PNG
(3-(4-Fluorophenyl)-7,7-dimethyl-2-(pyridin-4-yl)-6...)
Show SMILES CC1(C)CNC(=O)c2c1[nH]c(c2-c1ccc(F)cc1)-c1ccncc1
Show InChI InChI=1S/C20H18FN3O/c1-20(2)11-23-19(25)16-15(12-3-5-14(21)6-4-12)17(24-18(16)20)13-7-9-22-10-8-13/h3-10,24H,11H2,1-2H3,(H,23,25)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392962
PNG
(US10301306, Example 160)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccnc(NC(=O)C2CC2)c1
Show InChI InChI=1S/C30H23F2N5O2/c31-22-6-3-17(4-7-22)26-27-24(10-12-35-30(27)39)37(16-20-5-8-23(32)13-21(20)15-33)28(26)19-9-11-34-25(14-19)36-29(38)18-1-2-18/h3-9,11,13-14,18H,1-2,10,12,16H2,(H,35,39)(H,34,36,38)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392845
PNG
(US10301306, Example 43)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(cc2F)C(F)(F)F)c1-c1ccncc1
Show InChI InChI=1S/C26H18F5N3O/c27-19-5-2-15(3-6-19)22-23-21(9-12-33-25(23)35)34(24(22)16-7-10-32-11-8-16)14-17-1-4-18(13-20(17)28)26(29,30)31/h1-8,10-11,13H,9,12,14H2,(H,33,35)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392855
PNG
(US10301306, Example 53)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(cc2C(F)(F)F)C(F)(F)F)c1-c1ccncc1
Show InChI InChI=1S/C27H18F7N3O/c28-19-5-2-15(3-6-19)22-23-21(9-12-36-25(23)38)37(24(22)16-7-10-35-11-8-16)14-17-1-4-18(26(29,30)31)13-20(17)27(32,33)34/h1-8,10-11,13H,9,12,14H2,(H,36,38)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392857
PNG
(US10301306, Example 55)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C(F)(F)F)c1-c1ccncc1
Show InChI InChI=1S/C26H18F5N3O/c27-18-4-1-15(2-5-18)22-23-21(9-12-33-25(23)35)34(24(22)16-7-10-32-11-8-16)14-17-3-6-19(28)13-20(17)26(29,30)31/h1-8,10-11,13H,9,12,14H2,(H,33,35)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392873
PNG
(US10301306, Example 71)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2c(F)cc(F)cc2F)c1-c1ccncc1
Show InChI InChI=1S/C25H17F4N3O/c26-16-3-1-14(2-4-16)22-23-21(7-10-31-25(23)33)32(24(22)15-5-8-30-9-6-15)13-18-19(28)11-17(27)12-20(18)29/h1-6,8-9,11-12H,7,10,13H2,(H,31,33)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392876
PNG
(US10301306, Example 74)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(Cl)cc2F)c1-c1ccncc1
Show InChI InChI=1S/C25H18ClF2N3O/c26-18-4-1-17(20(28)13-18)14-31-21-9-12-30-25(32)23(21)22(15-2-5-19(27)6-3-15)24(31)16-7-10-29-11-8-16/h1-8,10-11,13H,9,12,14H2,(H,30,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392903
PNG
(US10301306, Example 101)
Show SMILES CC(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(cc1F)C(F)(F)F)-c1ccc(F)cc1
Show InChI InChI=1S/C28H21F5N4O2/c1-15(38)36-23-12-17(8-10-34-23)26-24(16-3-6-20(29)7-4-16)25-22(9-11-35-27(25)39)37(26)14-18-2-5-19(13-21(18)30)28(31,32)33/h2-8,10,12-13H,9,11,14H2,1H3,(H,35,39)(H,34,36,38)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392932
PNG
(US10301306, Example 130)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(-c3ccc(Cl)s3)c2-c2ccncc2)c(c1)C#N
Show InChI InChI=1S/C24H16ClFN4OS/c25-20-4-3-19(32-20)22-21-18(7-10-29-24(21)31)30(23(22)14-5-8-28-9-6-14)13-15-1-2-17(26)11-16(15)12-27/h1-6,8-9,11H,7,10,13H2,(H,29,31)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392961
PNG
(US10301306, Example 159)
Show SMILES Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(F)cc1C#N)-c1ccc(F)cc1
Show InChI InChI=1S/C26H19F2N5O/c27-19-4-1-15(2-5-19)23-24-21(8-10-32-26(24)34)33(25(23)16-7-9-31-22(30)12-16)14-17-3-6-20(28)11-18(17)13-29/h1-7,9,11-12H,8,10,14H2,(H2,30,31)(H,32,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392902
PNG
(US10301306, Example 100 | US10301306, Example 161)
Show SMILES CC(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(F)cc1C#N)-c1ccc(F)cc1
Show InChI InChI=1S/C28H21F2N5O2/c1-16(36)34-24-13-18(8-10-32-24)27-25(17-2-5-21(29)6-3-17)26-23(9-11-33-28(26)37)35(27)15-19-4-7-22(30)12-20(19)14-31/h2-8,10,12-13H,9,11,15H2,1H3,(H,33,37)(H,32,34,36)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392866
PNG
(US10301306, Example 64)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2F)c1-c1ccncc1
Show InChI InChI=1S/C25H18F3N3O/c26-18-4-1-15(2-5-18)22-23-21(9-12-30-25(23)32)31(24(22)16-7-10-29-11-8-16)14-17-3-6-19(27)13-20(17)28/h1-8,10-11,13H,9,12,14H2,(H,30,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392879
PNG
(US10301306, Example 77)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2c(F)cccc2C#N)c1-c1ccncc1
Show InChI InChI=1S/C26H18F2N4O/c27-19-6-4-16(5-7-19)23-24-22(10-13-31-26(24)33)32(25(23)17-8-11-30-12-9-17)15-20-18(14-29)2-1-3-21(20)28/h1-9,11-12H,10,13,15H2,(H,31,33)
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The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392804
PNG
(3-((3-(4-Fluorophenyl)-4-oxo-2-(pyridin-4-yl)-4,5,...)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2cccc(c2)C#N)c1-c1ccncc1
Show InChI InChI=1S/C26H19FN4O/c27-21-6-4-19(5-7-21)23-24-22(10-13-30-26(24)32)31(25(23)20-8-11-29-12-9-20)16-18-3-1-2-17(14-18)15-28/h1-9,11-12,14H,10,13,16H2,(H,30,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392806
PNG
(N-(4-(3-(4-Fluorophenyl)-1-(4-methylbenzyl)-4-oxo-...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(C)cc1)-c1ccc(F)cc1
Show InChI InChI=1S/C28H25FN4O2/c1-17-3-5-19(6-4-17)16-33-23-12-14-31-28(35)26(23)25(20-7-9-22(29)10-8-20)27(33)21-11-13-30-24(15-21)32-18(2)34/h3-11,13,15H,12,14,16H2,1-2H3,(H,31,35)(H,30,32,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392810
PNG
(N-(4-(1-(2-Fluoro-4-(trifluoromethyl)benzyl)-3-(4-...)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(cc2F)C(F)(F)F)c1-c1ccnc(NC(=O)C2CC2)c1
Show InChI InChI=1S/C30H23F5N4O2/c31-21-7-4-16(5-8-21)25-26-23(10-12-37-29(26)41)39(15-19-3-6-20(14-22(19)32)30(33,34)35)27(25)18-9-11-36-24(13-18)38-28(40)17-1-2-17/h3-9,11,13-14,17H,1-2,10,12,15H2,(H,37,41)(H,36,38,40)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392836
PNG
(US10301306, Example 34)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccncc1
Show InChI InChI=1S/C26H18F2N4O/c27-20-4-1-16(2-5-20)23-24-22(9-12-31-26(24)33)32(25(23)17-7-10-30-11-8-17)15-18-3-6-21(28)13-19(18)14-29/h1-8,10-11,13H,9,12,15H2,(H,31,33)
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The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392846
PNG
(US10301306, Example 44)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccc(F)cc2)cc1
Show InChI InChI=1S/C25H19F2N3O/c26-19-5-1-16(2-6-19)15-30-21-11-14-29-25(31)23(21)22(17-3-7-20(27)8-4-17)24(30)18-9-12-28-13-10-18/h1-10,12-13H,11,14-15H2,(H,29,31)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392870
PNG
(US10301306, Example 68)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccccc2C#N)c1-c1ccncc1
Show InChI InChI=1S/C26H19FN4O/c27-21-7-5-17(6-8-21)23-24-22(11-14-30-26(24)32)31(25(23)18-9-12-29-13-10-18)16-20-4-2-1-3-19(20)15-28/h1-10,12-13H,11,14,16H2,(H,30,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392877
PNG
(US10301306, Example 75)
Show SMILES CC(C)(C)CCn1c2CCNC(=O)c2c(c1-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C24H26FN3O/c1-24(2,3)11-15-28-19-10-14-27-23(29)21(19)20(16-4-6-18(25)7-5-16)22(28)17-8-12-26-13-9-17/h4-9,12-13H,10-11,14-15H2,1-3H3,(H,27,29)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392919
PNG
(US10301306, Example 117)
Show SMILES COc1cc(F)cc(c1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccncc1
Show InChI InChI=1S/C27H20F2N4O2/c1-35-22-12-18(10-21(29)13-22)24-25-23(6-9-32-27(25)34)33(26(24)16-4-7-31-8-5-16)15-17-2-3-20(28)11-19(17)14-30/h2-5,7-8,10-13H,6,9,15H2,1H3,(H,32,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392889
PNG
(US10301306, Example 87)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(CC2CCOCC2)c1-c1ccnc(NC(=O)C2CC2)c1
Show InChI InChI=1S/C28H29FN4O3/c29-21-5-3-18(4-6-21)24-25-22(8-12-31-28(25)35)33(16-17-9-13-36-14-10-17)26(24)20-7-11-30-23(15-20)32-27(34)19-1-2-19/h3-7,11,15,17,19H,1-2,8-10,12-14,16H2,(H,31,35)(H,30,32,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392921
PNG
(US10301306, Example 119)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2cccnc2)c(c1)C#N
Show InChI InChI=1S/C25H18FN5O/c26-20-4-3-18(19(12-20)13-27)15-31-21-7-11-30-25(32)23(21)22(17-2-1-8-29-14-17)24(31)16-5-9-28-10-6-16/h1-6,8-10,12,14H,7,11,15H2,(H,30,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392941
PNG
(US10301306, Example 139)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2cccc(c2)C#N)c(c1)C#N
Show InChI InChI=1S/C27H18FN5O/c28-22-5-4-20(21(13-22)15-30)16-33-23-8-11-32-27(34)25(23)24(19-3-1-2-17(12-19)14-29)26(33)18-6-9-31-10-7-18/h1-7,9-10,12-13H,8,11,16H2,(H,32,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392948
PNG
(US10301306, Example 146)
Show SMILES OCCNc1cc(ccn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(cc1F)C(F)(F)F)-c1ccc(F)cc1
Show InChI InChI=1S/C28H23F5N4O2/c29-20-5-2-16(3-6-20)24-25-22(8-10-36-27(25)39)37(15-18-1-4-19(14-21(18)30)28(31,32)33)26(24)17-7-9-34-23(13-17)35-11-12-38/h1-7,9,13-14,38H,8,10-12,15H2,(H,34,35)(H,36,39)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392965
PNG
(US10301306, Example 163)
Show SMILES CC(C)(C)OC(=O)Nc1cccc(c1)-c1c2c(CCNC2=O)n(Cc2ccc(Cl)cc2F)c1-c1ccncc1
Show InChI InChI=1S/C30H28ClFN4O3/c1-30(2,3)39-29(38)35-22-6-4-5-19(15-22)25-26-24(11-14-34-28(26)37)36(27(25)18-9-12-33-13-10-18)17-20-7-8-21(31)16-23(20)32/h4-10,12-13,15-16H,11,14,17H2,1-3H3,(H,34,37)(H,35,38)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392847
PNG
(US10301306, Example 45)
Show SMILES Cc1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccc(F)cc2)cc1
Show InChI InChI=1S/C26H22FN3O/c1-17-2-4-18(5-3-17)16-30-22-12-15-29-26(31)24(22)23(19-6-8-21(27)9-7-19)25(30)20-10-13-28-14-11-20/h2-11,13-14H,12,15-16H2,1H3,(H,29,31)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392860
PNG
(US10301306, Example 58)
Show SMILES CC(C)Cn1c2CCNC(=O)c2c(c1-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C22H22FN3O/c1-14(2)13-26-18-9-12-25-22(27)20(18)19(15-3-5-17(23)6-4-15)21(26)16-7-10-24-11-8-16/h3-8,10-11,14H,9,12-13H2,1-2H3,(H,25,27)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392984
PNG
(US10301306, Example 182)
Show SMILES Cc1cc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2F)-c2ccc(F)cc2)n(C)n1
Show InChI InChI=1S/C24H21F2N5O/c1-14-11-17(30(2)29-14)13-31-20-8-10-28-24(32)22(20)21(15-3-5-16(25)6-4-15)23(31)18-7-9-27-12-19(18)26/h3-7,9,11-12H,8,10,13H2,1-2H3,(H,28,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392960
PNG
(US10301306, Example 158)
Show SMILES CC(C)(C)OC(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(F)cc1C#N)-c1ccc(F)cc1
Show InChI InChI=1S/C31H27F2N5O3/c1-31(2,3)41-30(40)37-25-15-19(10-12-35-25)28-26(18-4-7-22(32)8-5-18)27-24(11-13-36-29(27)39)38(28)17-20-6-9-23(33)14-21(20)16-34/h4-10,12,14-15H,11,13,17H2,1-3H3,(H,36,39)(H,35,37,40)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392869
PNG
(US10301306, Example 67)
Show SMILES COc1cc(ccc1Cn1c2CCNC(=O)c2c(c1-c1ccncc1)-c1ccc(F)cc1)C(F)(F)F
Show InChI InChI=1S/C27H21F4N3O2/c1-36-22-14-19(27(29,30)31)5-2-18(22)15-34-21-10-13-33-26(35)24(21)23(16-3-6-20(28)7-4-16)25(34)17-8-11-32-12-9-17/h2-9,11-12,14H,10,13,15H2,1H3,(H,33,35)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392871
PNG
(US10301306, Example 69)
Show SMILES OCCCn1c2CCNC(=O)c2c(c1-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C21H20FN3O2/c22-16-4-2-14(3-5-16)18-19-17(8-11-24-21(19)27)25(12-1-13-26)20(18)15-6-9-23-10-7-15/h2-7,9-10,26H,1,8,11-13H2,(H,24,27)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392916
PNG
(US10301306, Example 114)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2cccc(OC(F)(F)F)c2)c(c1)C#N
Show InChI InChI=1S/C27H18F4N4O2/c28-20-5-4-18(19(12-20)14-32)15-35-22-8-11-34-26(36)24(22)23(25(35)16-6-9-33-10-7-16)17-2-1-3-21(13-17)37-27(29,30)31/h1-7,9-10,12-13H,8,11,15H2,(H,34,36)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392811
PNG
(5-Fluoro-2-((4-oxo-2-(pyridin-4-yl)-3-(4-(trifluor...)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccc(cc2)C(F)(F)F)c(c1)C#N
Show InChI InChI=1S/C27H18F4N4O/c28-21-6-3-18(19(13-21)14-32)15-35-22-9-12-34-26(36)24(22)23(25(35)17-7-10-33-11-8-17)16-1-4-20(5-2-16)27(29,30)31/h1-8,10-11,13H,9,12,15H2,(H,34,36)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392817
PNG
(US10301306, Example 15)
Show SMILES COc1cnccc1-c1c(c2c(CCNC2=O)n1Cc1ccc(F)cc1C#N)-c1ccc(F)cc1
Show InChI InChI=1S/C27H20F2N4O2/c1-35-23-14-31-10-8-21(23)26-24(16-2-5-19(28)6-3-16)25-22(9-11-32-27(25)34)33(26)15-17-4-7-20(29)12-18(17)13-30/h2-8,10,12,14H,9,11,15H2,1H3,(H,32,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392883
PNG
(US10301306, Example 81)
Show SMILES Cc1nc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccc(F)cc2)no1
Show InChI InChI=1S/C22H18FN5O2/c1-13-26-18(27-30-13)12-28-17-8-11-25-22(29)20(17)19(14-2-4-16(23)5-3-14)21(28)15-6-9-24-10-7-15/h2-7,9-10H,8,11-12H2,1H3,(H,25,29)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392931
PNG
(US10301306, Example 129)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2cccc(Cl)c2Cl)c(c1)C#N
Show InChI InChI=1S/C26H17Cl2FN4O/c27-20-3-1-2-19(24(20)28)22-23-21(8-11-32-26(23)34)33(25(22)15-6-9-31-10-7-15)14-16-4-5-18(29)12-17(16)13-30/h1-7,9-10,12H,8,11,14H2,(H,32,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392952
PNG
(US10301306, Example 150)
Show SMILES COCC(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(cc1F)C(F)(F)F)-c1ccc(F)cc1
Show InChI InChI=1S/C29H23F5N4O3/c1-41-15-24(39)37-23-12-17(8-10-35-23)27-25(16-3-6-20(30)7-4-16)26-22(9-11-36-28(26)40)38(27)14-18-2-5-19(13-21(18)31)29(32,33)34/h2-8,10,12-13H,9,11,14-15H2,1H3,(H,36,40)(H,35,37,39)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392901
PNG
(US10301306, Example 99)
Show SMILES CC(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(F)c(c1)C#N)-c1ccc(F)cc1
Show InChI InChI=1S/C28H21F2N5O2/c1-16(36)34-24-13-19(8-10-32-24)27-25(18-3-5-21(29)6-4-18)26-23(9-11-33-28(26)37)35(27)15-17-2-7-22(30)20(12-17)14-31/h2-8,10,12-13H,9,11,15H2,1H3,(H,33,37)(H,32,34,36)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392947
PNG
(US10301306, Example 145)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(\C=C\c3ccccc3)c2-c2ccncc2)c(c1)C#N
Show InChI InChI=1S/C28H21FN4O/c29-23-8-7-21(22(16-23)17-30)18-33-25-12-15-32-28(34)26(25)24(9-6-19-4-2-1-3-5-19)27(33)20-10-13-31-14-11-20/h1-11,13-14,16H,12,15,18H2,(H,32,34)/b9-6+
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392951
PNG
(US10301306, Example 149)
Show SMILES CCC(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(cc1F)C(F)(F)F)-c1ccc(F)cc1
Show InChI InChI=1S/C29H23F5N4O2/c1-2-24(39)37-23-13-17(9-11-35-23)27-25(16-4-7-20(30)8-5-16)26-22(10-12-36-28(26)40)38(27)15-18-3-6-19(14-21(18)31)29(32,33)34/h3-9,11,13-14H,2,10,12,15H2,1H3,(H,36,40)(H,35,37,39)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392973
PNG
(US10301306, Example 171)
Show SMILES Cc1cc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2cccc(NC(=O)OC(C)(C)C)c2)n(C)n1
Show InChI InChI=1S/C29H32N6O3/c1-18-15-22(34(5)33-18)17-35-23-11-14-31-27(36)25(23)24(26(35)19-9-12-30-13-10-19)20-7-6-8-21(16-20)32-28(37)38-29(2,3)4/h6-10,12-13,15-16H,11,14,17H2,1-5H3,(H,31,36)(H,32,37)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392862
PNG
(US10301306, Example 60)
Show SMILES Cc1nc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccc(F)cc2)cs1
Show InChI InChI=1S/C23H19FN4OS/c1-14-27-18(13-30-14)12-28-19-8-11-26-23(29)21(19)20(15-2-4-17(24)5-3-15)22(28)16-6-9-25-10-7-16/h2-7,9-10,13H,8,11-12H2,1H3,(H,26,29)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392897
PNG
(US10301306, Example 95)
Show SMILES CCOC(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1CC1CCOCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C27H29FN4O4/c1-2-36-27(34)31-22-15-19(7-11-29-22)25-23(18-3-5-20(28)6-4-18)24-21(8-12-30-26(24)33)32(25)16-17-9-13-35-14-10-17/h3-7,11,15,17H,2,8-10,12-14,16H2,1H3,(H,30,33)(H,29,31,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392831
PNG
(US10301306, Example 29)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(c1-c1ccncc1)-c1ccccc1
Show InChI InChI=1S/C24H18FN3O/c25-18-8-6-16(7-9-18)21-22-20(12-15-27-24(22)29)28(19-4-2-1-3-5-19)23(21)17-10-13-26-14-11-17/h1-11,13-14H,12,15H2,(H,27,29)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392854
PNG
(US10301306, Example 52)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(cc2)C2CC2)c1-c1ccncc1
Show InChI InChI=1S/C28H24FN3O/c29-23-9-7-21(8-10-23)25-26-24(13-16-31-28(26)33)32(27(25)22-11-14-30-15-12-22)17-18-1-3-19(4-2-18)20-5-6-20/h1-4,7-12,14-15,20H,5-6,13,16-17H2,(H,31,33)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392856
PNG
(US10301306, Example 54)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(cn2)C#N)c1-c1ccncc1
Show InChI InChI=1S/C25H18FN5O/c26-19-4-2-17(3-5-19)22-23-21(9-12-29-25(23)32)31(24(22)18-7-10-28-11-8-18)15-20-6-1-16(13-27)14-30-20/h1-8,10-11,14H,9,12,15H2,(H,29,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392881
PNG
(US10301306, Example 79)
Show SMILES Cc1cc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccc(F)cc2)no1
Show InChI InChI=1S/C23H19FN4O2/c1-14-12-18(27-30-14)13-28-19-8-11-26-23(29)21(19)20(15-2-4-17(24)5-3-15)22(28)16-6-9-25-10-7-16/h2-7,9-10,12H,8,11,13H2,1H3,(H,26,29)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392923
PNG
(US10301306, Example 121)
Show SMILES COc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccncc1
Show InChI InChI=1S/C27H21FN4O2/c1-34-22-6-3-17(4-7-22)24-25-23(10-13-31-27(25)33)32(26(24)18-8-11-30-12-9-18)16-19-2-5-21(28)14-20(19)15-29/h2-9,11-12,14H,10,13,16H2,1H3,(H,31,33)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392822
PNG
(US10301306, Example 20)
Show SMILES Cc1cc(ccn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(F)cc1C#N)-c1ccc(F)cc1
Show InChI InChI=1S/C27H20F2N4O/c1-16-12-18(8-10-31-16)26-24(17-2-5-21(28)6-3-17)25-23(9-11-32-27(25)34)33(26)15-19-4-7-22(29)13-20(19)14-30/h2-8,10,12-13H,9,11,15H2,1H3,(H,32,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392837
PNG
(US10301306, Example 35)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(C#N)c(F)c2)c1-c1ccncc1
Show InChI InChI=1S/C26H18F2N4O/c27-20-5-3-17(4-6-20)23-24-22(9-12-31-26(24)33)32(25(23)18-7-10-30-11-8-18)15-16-1-2-19(14-29)21(28)13-16/h1-8,10-11,13H,9,12,15H2,(H,31,33)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392859
PNG
(US10301306, Example 57)
Show SMILES CCCCCn1c2CCNC(=O)c2c(c1-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C23H24FN3O/c1-2-3-4-15-27-19-11-14-26-23(28)21(19)20(16-5-7-18(24)8-6-16)22(27)17-9-12-25-13-10-17/h5-10,12-13H,2-4,11,14-15H2,1H3,(H,26,28)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392872
PNG
(US10301306, Example 70)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(CC(=O)N2CCCC2)c1-c1ccncc1
Show InChI InChI=1S/C24H23FN4O2/c25-18-5-3-16(4-6-18)21-22-19(9-12-27-24(22)31)29(15-20(30)28-13-1-2-14-28)23(21)17-7-10-26-11-8-17/h3-8,10-11H,1-2,9,12-15H2,(H,27,31)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392830
PNG
(US10301306, Example 28)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(cc2)C#N)c1-c1ccncc1
Show InChI InChI=1S/C26H19FN4O/c27-21-7-5-19(6-8-21)23-24-22(11-14-30-26(24)32)31(25(23)20-9-12-29-13-10-20)16-18-3-1-17(15-28)2-4-18/h1-10,12-13H,11,14,16H2,(H,30,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392835
PNG
(US10301306, Example 33)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(cc2)C(F)(F)F)c1-c1ccncc1
Show InChI InChI=1S/C26H19F4N3O/c27-20-7-3-17(4-8-20)22-23-21(11-14-32-25(23)34)33(24(22)18-9-12-31-13-10-18)15-16-1-5-19(6-2-16)26(28,29)30/h1-10,12-13H,11,14-15H2,(H,32,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392920
PNG
(US10301306, Example 118)
Show SMILES Cn1ccc2cc(ccc12)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccncc1
Show InChI InChI=1S/C29H22FN5O/c1-34-13-9-19-14-20(3-5-24(19)34)26-27-25(8-12-33-29(27)36)35(28(26)18-6-10-32-11-7-18)17-21-2-4-23(30)15-22(21)16-31/h2-7,9-11,13-15H,8,12,17H2,1H3,(H,33,36)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392803
PNG
(5-Fluoro-2-((3-(4-fluorophenyl)-2-(3-methyl-1H-pyr...)
Show SMILES Cc1n[nH]cc1-c1c(c2c(CCNC2=O)n1Cc1ccc(F)cc1C#N)-c1ccc(F)cc1
Show InChI InChI=1S/C25H19F2N5O/c1-14-20(12-30-31-14)24-22(15-2-5-18(26)6-3-15)23-21(8-9-29-25(23)33)32(24)13-16-4-7-19(27)10-17(16)11-28/h2-7,10,12H,8-9,13H2,1H3,(H,29,33)(H,30,31)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392808
PNG
(2-(2-Chloropyridin-4-yl)-1-(2-fluoro-4-(trifluorom...)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(cc2F)C(F)(F)F)c1-c1ccnc(Cl)c1
Show InChI InChI=1S/C26H17ClF5N3O/c27-21-11-15(7-9-33-21)24-22(14-2-5-18(28)6-3-14)23-20(8-10-34-25(23)36)35(24)13-16-1-4-17(12-19(16)29)26(30,31)32/h1-7,9,11-12H,8,10,13H2,(H,34,36)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392821
PNG
(US10301306, Example 19)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccc2[nH]ccc2c1
Show InChI InChI=1S/C29H20F2N4O/c30-22-5-1-17(2-6-22)26-27-25(10-12-34-29(27)36)35(16-20-3-7-23(31)14-21(20)15-32)28(26)19-4-8-24-18(13-19)9-11-33-24/h1-9,11,13-14,33H,10,12,16H2,(H,34,36)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392825
PNG
(US10301306, Example 23)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccoc1
Show InChI InChI=1S/C25H17F2N3O2/c26-19-4-1-15(2-5-19)22-23-21(7-9-29-25(23)31)30(24(22)17-8-10-32-14-17)13-16-3-6-20(27)11-18(16)12-28/h1-6,8,10-11,14H,7,9,13H2,(H,29,31)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392827
PNG
(US10301306, Example 25)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccsc1
Show InChI InChI=1S/C25H17F2N3OS/c26-19-4-1-15(2-5-19)22-23-21(7-9-29-25(23)31)30(24(22)17-8-10-32-14-17)13-16-3-6-20(27)11-18(16)12-28/h1-6,8,10-11,14H,7,9,13H2,(H,29,31)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392828
PNG
(US10301306, Example 26)
Show SMILES COc1ncc(cn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(F)cc1C#N)-c1ccc(F)cc1
Show InChI InChI=1S/C26H19F2N5O2/c1-35-26-31-12-18(13-32-26)24-22(15-2-5-19(27)6-3-15)23-21(8-9-30-25(23)34)33(24)14-16-4-7-20(28)10-17(16)11-29/h2-7,10,12-13H,8-9,14H2,1H3,(H,30,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392839
PNG
(US10301306, Example 37)
Show SMILES COc1ccc(CCn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccc(F)cc2)cc1
Show InChI InChI=1S/C27H24FN3O2/c1-33-22-8-2-18(3-9-22)13-17-31-23-12-16-30-27(32)25(23)24(19-4-6-21(28)7-5-19)26(31)20-10-14-29-15-11-20/h2-11,14-15H,12-13,16-17H2,1H3,(H,30,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392852
PNG
(US10301306, Example 50)
Show SMILES Cc1noc(C)c1Cn1c2CCNC(=O)c2c(c1-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C24H21FN4O2/c1-14-19(15(2)31-28-14)13-29-20-9-12-27-24(30)22(20)21(16-3-5-18(25)6-4-16)23(29)17-7-10-26-11-8-17/h3-8,10-11H,9,12-13H2,1-2H3,(H,27,30)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392885
PNG
(US10301306, Example 83)
Show SMILES CC(C)NC(=O)Cn1c2CCNC(=O)c2c(c1-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C23H23FN4O2/c1-14(2)27-19(29)13-28-18-9-12-26-23(30)21(18)20(15-3-5-17(24)6-4-15)22(28)16-7-10-25-11-8-16/h3-8,10-11,14H,9,12-13H2,1-2H3,(H,26,30)(H,27,29)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392888
PNG
(US10301306, Example 86)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(CC2CCOCC2)c1-c1ccnc(NC(=O)c2ccccc2)c1
Show InChI InChI=1S/C31H29FN4O3/c32-24-8-6-21(7-9-24)27-28-25(11-15-34-31(28)38)36(19-20-12-16-39-17-13-20)29(27)23-10-14-33-26(18-23)35-30(37)22-4-2-1-3-5-22/h1-10,14,18,20H,11-13,15-17,19H2,(H,34,38)(H,33,35,37)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392892
PNG
(US10301306, Example 90)
Show SMILES CCC(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1CC1CCOCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C27H29FN4O3/c1-2-23(33)31-22-15-19(7-11-29-22)26-24(18-3-5-20(28)6-4-18)25-21(8-12-30-27(25)34)32(26)16-17-9-13-35-14-10-17/h3-7,11,15,17H,2,8-10,12-14,16H2,1H3,(H,30,34)(H,29,31,33)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392893
PNG
(US10301306, Example 91)
Show SMILES CC(C)OC(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1CC1CCOCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C28H31FN4O4/c1-17(2)37-28(35)32-23-15-20(7-11-30-23)26-24(19-3-5-21(29)6-4-19)25-22(8-12-31-27(25)34)33(26)16-18-9-13-36-14-10-18/h3-7,11,15,17-18H,8-10,12-14,16H2,1-2H3,(H,31,34)(H,30,32,35)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392986
PNG
(US10301306, Example 184)
Show SMILES Cc1cc(Cn2c3CCNC(=O)c3c(c2-c2cn[nH]c2)-c2ccc(F)cc2)n(C)n1
Show InChI InChI=1S/C22H21FN6O/c1-13-9-17(28(2)27-13)12-29-18-7-8-24-22(30)20(18)19(14-3-5-16(23)6-4-14)21(29)15-10-25-26-11-15/h3-6,9-11H,7-8,12H2,1-2H3,(H,24,30)(H,25,26)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392894
PNG
(US10301306, Example 92)
Show SMILES CS(=O)(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1CC1CCOCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C25H27FN4O4S/c1-35(32,33)29-21-14-18(6-10-27-21)24-22(17-2-4-19(26)5-3-17)23-20(7-11-28-25(23)31)30(24)15-16-8-12-34-13-9-16/h2-6,10,14,16H,7-9,11-13,15H2,1H3,(H,27,29)(H,28,31)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392895
PNG
(US10301306, Example 93 | US10301306, Example 98)
Show SMILES CC(C)CC(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1CC1CCOCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C29H33FN4O3/c1-18(2)15-25(35)33-24-16-21(7-11-31-24)28-26(20-3-5-22(30)6-4-20)27-23(8-12-32-29(27)36)34(28)17-19-9-13-37-14-10-19/h3-7,11,16,18-19H,8-10,12-15,17H2,1-2H3,(H,32,36)(H,31,33,35)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392918
PNG
(US10301306, Example 116)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccc3ncccc3c2)c(c1)C#N
Show InChI InChI=1S/C29H20FN5O/c30-23-5-3-21(22(15-23)16-31)17-35-25-9-13-34-29(36)27(25)26(28(35)18-7-11-32-12-8-18)20-4-6-24-19(14-20)2-1-10-33-24/h1-8,10-12,14-15H,9,13,17H2,(H,34,36)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392935
PNG
(US10301306, Example 133)
Show SMILES NS(=O)(=O)c1cccc(c1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccncc1
Show InChI InChI=1S/C26H20FN5O3S/c27-20-5-4-18(19(12-20)14-28)15-32-22-8-11-31-26(33)24(22)23(25(32)16-6-9-30-10-7-16)17-2-1-3-21(13-17)36(29,34)35/h1-7,9-10,12-13H,8,11,15H2,(H,31,33)(H2,29,34,35)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392954
PNG
(3-(4-Fluorophenyl)-7,7-dimethyl-2-(pyridin-4-yl)-1...)
Show SMILES CC1(C)CNC(=O)c2c(c(-c3ccncc3)n(CC3CCOCC3)c12)-c1ccc(F)cc1
Show InChI InChI=1S/C26H28FN3O2/c1-26(2)16-29-25(31)22-21(18-3-5-20(27)6-4-18)23(19-7-11-28-12-8-19)30(24(22)26)15-17-9-13-32-14-10-17/h3-8,11-12,17H,9-10,13-16H2,1-2H3,(H,29,31)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392808
PNG
(2-(2-Chloropyridin-4-yl)-1-(2-fluoro-4-(trifluorom...)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(cc2F)C(F)(F)F)c1-c1ccnc(Cl)c1
Show InChI InChI=1S/C26H17ClF5N3O/c27-21-11-15(7-9-33-21)24-22(14-2-5-18(28)6-3-14)23-20(8-10-34-25(23)36)35(24)13-16-1-4-17(12-19(16)29)26(30,31)32/h1-7,9,11-12H,8,10,13H2,(H,34,36)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392964
PNG
(3-(4-Fluorophenyl)-2-(pyridin-4-yl)-1-tosyl-6,7-di...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)n1c2CCNC(=O)c2c(c1-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C25H20FN3O3S/c1-16-2-8-20(9-3-16)33(31,32)29-21-12-15-28-25(30)23(21)22(17-4-6-19(26)7-5-17)24(29)18-10-13-27-14-11-18/h2-11,13-14H,12,15H2,1H3,(H,28,30)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392968
PNG
(US10301306, Example 166)
Show SMILES Fc1cc(Cl)ccc1Cn1c2CCNC(=O)c2c(c1-c1ccncc1)-c1ccncc1F
Show InChI InChI=1S/C24H17ClF2N4O/c25-16-2-1-15(18(26)11-16)13-31-20-6-10-30-24(32)22(20)21(17-5-9-29-12-19(17)27)23(31)14-3-7-28-8-4-14/h1-5,7-9,11-12H,6,10,13H2,(H,30,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392805
PNG
(N-(4-(3-(4-Fluorophenyl)-4-oxo-1-((tetrahydro-2H-p...)
Show SMILES CC(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1CC1CCOCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C26H27FN4O3/c1-16(32)30-22-14-19(6-10-28-22)25-23(18-2-4-20(27)5-3-18)24-21(7-11-29-26(24)33)31(25)15-17-8-12-34-13-9-17/h2-6,10,14,17H,7-9,11-13,15H2,1H3,(H,29,33)(H,28,30,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392813
PNG
(2-((2-(2-Chloropyridin-4-yl)-4-oxo-3-(pyridin-3-yl...)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccnc(Cl)c2)-c2cccnc2)c(c1)C#N
Show InChI InChI=1S/C25H17ClFN5O/c26-21-11-15(5-8-30-21)24-22(16-2-1-7-29-13-16)23-20(6-9-31-25(23)33)32(24)14-17-3-4-19(27)10-18(17)12-28/h1-5,7-8,10-11,13H,6,9,14H2,(H,31,33)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392818
PNG
(US10301306, Example 16)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccnc(c1)C(F)(F)F
Show InChI InChI=1S/C27H17F5N4O/c28-19-4-1-15(2-5-19)23-24-21(8-10-35-26(24)37)36(14-17-3-6-20(29)11-18(17)13-33)25(23)16-7-9-34-22(12-16)27(30,31)32/h1-7,9,11-12H,8,10,14H2,(H,35,37)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392844
PNG
(US10301306, Example 42)
Show SMILES CS(=O)(=O)c1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccc(F)cc2)cc1
Show InChI InChI=1S/C26H22FN3O3S/c1-34(32,33)21-8-2-17(3-9-21)16-30-22-12-15-29-26(31)24(22)23(18-4-6-20(27)7-5-18)25(30)19-10-13-28-14-11-19/h2-11,13-14H,12,15-16H2,1H3,(H,29,31)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392851
PNG
(US10301306, Example 49)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(CC#N)c1-c1ccncc1
Show InChI InChI=1S/C20H15FN4O/c21-15-3-1-13(2-4-15)17-18-16(7-11-24-20(18)26)25(12-8-22)19(17)14-5-9-23-10-6-14/h1-6,9-10H,7,11-12H2,(H,24,26)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392878
PNG
(US10301306, Example 76)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccccn2)c1-c1ccncc1
Show InChI InChI=1S/C24H19FN4O/c25-18-6-4-16(5-7-18)21-22-20(10-14-28-24(22)30)29(15-19-3-1-2-11-27-19)23(21)17-8-12-26-13-9-17/h1-9,11-13H,10,14-15H2,(H,28,30)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392987
PNG
(US10301306, Example 185++)
Show SMILES Cc1cc(Cn2c3CCNC(=O)c3c(c2-c2ccnc(NC(=O)C3CC3)c2)-c2cccc(NC(=O)OC(C)(C)C)c2)n(C)n1
Show InChI InChI=1S/C33H37N7O4/c1-19-15-24(39(5)38-19)18-40-25-12-14-35-31(42)28(25)27(21-7-6-8-23(16-21)36-32(43)44-33(2,3)4)29(40)22-11-13-34-26(17-22)37-30(41)20-9-10-20/h6-8,11,13,15-17,20H,9-10,12,14,18H2,1-5H3,(H,35,42)(H,36,43)(H,34,37,41)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392910
PNG
(US10301306, Example 108)
Show SMILES O=C1NCCc2c1c(c(-c1ccncc1)n2CC1CCOCC1)-c1cccnc1
Show InChI InChI=1S/C23H24N4O2/c28-23-21-19(5-11-26-23)27(15-16-6-12-29-13-7-16)22(17-3-9-24-10-4-17)20(21)18-2-1-8-25-14-18/h1-4,8-10,14,16H,5-7,11-13,15H2,(H,26,28)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392911
PNG
(US10301306, Example 109)
Show SMILES CN(C)c1cccc(c1)-c1c2c(CCNC2=O)n(CC2CCOCC2)c1-c1ccncc1
Show InChI InChI=1S/C26H30N4O2/c1-29(2)21-5-3-4-20(16-21)23-24-22(8-13-28-26(24)31)30(17-18-9-14-32-15-10-18)25(23)19-6-11-27-12-7-19/h3-7,11-12,16,18H,8-10,13-15,17H2,1-2H3,(H,28,31)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392949
PNG
(US10301306, Example 147)
Show SMILES COCCNc1cc(ccn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(cc1F)C(F)(F)F)-c1ccc(F)cc1
Show InChI InChI=1S/C29H25F5N4O2/c1-40-13-12-36-24-14-18(8-10-35-24)27-25(17-3-6-21(30)7-4-17)26-23(9-11-37-28(26)39)38(27)16-19-2-5-20(15-22(19)31)29(32,33)34/h2-8,10,14-15H,9,11-13,16H2,1H3,(H,35,36)(H,37,39)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392812
PNG
(1-(2-Fluoro-4-(trifluoromethyl)benzyl)-2-(2-(methy...)
Show SMILES CNc1cc(ccn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(cc1F)C(F)(F)F)-c1ccc(F)cc1
Show InChI InChI=1S/C27H21F5N4O/c1-33-22-12-16(8-10-34-22)25-23(15-3-6-19(28)7-4-15)24-21(9-11-35-26(24)37)36(25)14-17-2-5-18(13-20(17)29)27(30,31)32/h2-8,10,12-13H,9,11,14H2,1H3,(H,33,34)(H,35,37)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392974
PNG
(US10301306, Example 172)
Show SMILES COC(=O)c1cccc(c1)-c1c2c(CCNC2=O)n(Cc2cc(C)nn2C)c1-c1ccncc1
Show InChI InChI=1S/C26H25N5O3/c1-16-13-20(30(2)29-16)15-31-21-9-12-28-25(32)23(21)22(24(31)17-7-10-27-11-8-17)18-5-4-6-19(14-18)26(33)34-3/h4-8,10-11,13-14H,9,12,15H2,1-3H3,(H,28,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392975
PNG
(US10301306, Example 173)
Show SMILES Cc1cc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2cccc(c2)-c2c(C)noc2C)n(C)n1
Show InChI InChI=1S/C29H28N6O2/c1-17-14-23(34(4)32-17)16-35-24-10-13-31-29(36)27(24)26(28(35)20-8-11-30-12-9-20)22-7-5-6-21(15-22)25-18(2)33-37-19(25)3/h5-9,11-12,14-15H,10,13,16H2,1-4H3,(H,31,36)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392812
PNG
(1-(2-Fluoro-4-(trifluoromethyl)benzyl)-2-(2-(methy...)
Show SMILES CNc1cc(ccn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(cc1F)C(F)(F)F)-c1ccc(F)cc1
Show InChI InChI=1S/C27H21F5N4O/c1-33-22-12-16(8-10-34-22)25-23(15-3-6-19(28)7-4-15)24-21(9-11-35-26(24)37)36(25)14-17-2-5-18(13-20(17)29)27(30,31)32/h2-8,10,12-13H,9,11,14H2,1H3,(H,33,34)(H,35,37)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392832
PNG
(US10301306, Example 30)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(CC2CCNCC2)c1-c1ccncc1
Show InChI InChI=1S/C24H25FN4O/c25-19-3-1-17(2-4-19)21-22-20(9-14-28-24(22)30)29(15-16-5-10-26-11-6-16)23(21)18-7-12-27-13-8-18/h1-4,7-8,12-13,16,26H,5-6,9-11,14-15H2,(H,28,30)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392834
PNG
(US10301306, Example 32)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(CC2CCCNC2)c1-c1ccncc1
Show InChI InChI=1S/C24H25FN4O/c25-19-5-3-17(4-6-19)21-22-20(9-13-28-24(22)30)29(15-16-2-1-10-27-14-16)23(21)18-7-11-26-12-8-18/h3-8,11-12,16,27H,1-2,9-10,13-15H2,(H,28,30)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392858
PNG
(US10301306, Example 56)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2nnc(o2)C2CC2)c1-c1ccncc1
Show InChI InChI=1S/C24H20FN5O2/c25-17-5-3-14(4-6-17)20-21-18(9-12-27-23(21)31)30(22(20)15-7-10-26-11-8-15)13-19-28-29-24(32-19)16-1-2-16/h3-8,10-11,16H,1-2,9,12-13H2,(H,27,31)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392890
PNG
(US10301306, Example 88)
Show SMILES CC(C)C(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1CC1CCOCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C28H31FN4O3/c1-17(2)27(34)32-23-15-20(7-11-30-23)26-24(19-3-5-21(29)6-4-19)25-22(8-12-31-28(25)35)33(26)16-18-9-13-36-14-10-18/h3-7,11,15,17-18H,8-10,12-14,16H2,1-2H3,(H,31,35)(H,30,32,34)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392981
PNG
(US10301306, Example 179)
Show SMILES CCC(=O)Nc1cccc(c1)-c1c2c(CCNC2=O)n(Cc2cc(C)nn2C)c1-c1ccncc1
Show InChI InChI=1S/C27H28N6O2/c1-4-23(34)30-20-7-5-6-19(15-20)24-25-22(10-13-29-27(25)35)33(16-21-14-17(2)31-32(21)3)26(24)18-8-11-28-12-9-18/h5-9,11-12,14-15H,4,10,13,16H2,1-3H3,(H,29,35)(H,30,34)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392905
PNG
(US10301306, Example 103)
Show SMILES Cc1ccc(-c2c3c(CCNC3=O)n(CC3CCOCC3)c2-c2ccncc2)c(C)c1
Show InChI InChI=1S/C26H29N3O2/c1-17-3-4-21(18(2)15-17)23-24-22(7-12-28-26(24)30)29(16-19-8-13-31-14-9-19)25(23)20-5-10-27-11-6-20/h3-6,10-11,15,19H,7-9,12-14,16H2,1-2H3,(H,28,30)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392909
PNG
(US10301306, Example 107)
Show SMILES COc1ccc(cn1)-c1c2c(CCNC2=O)n(CC2CCOCC2)c1-c1ccncc1
Show InChI InChI=1S/C24H26N4O3/c1-30-20-3-2-18(14-27-20)21-22-19(6-11-26-24(22)29)28(15-16-7-12-31-13-8-16)23(21)17-4-9-25-10-5-17/h2-5,9-10,14,16H,6-8,11-13,15H2,1H3,(H,26,29)
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US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392956
PNG
(3-(4-Fluorophenyl)-1,7,7-trimethyl-2-(pyridin-4-yl...)
Show SMILES Cn1c(c(c2c1C(C)(C)CNC2=O)-c1ccc(F)cc1)-c1ccncc1
Show InChI InChI=1S/C21H20FN3O/c1-21(2)12-24-20(26)17-16(13-4-6-15(22)7-5-13)18(25(3)19(17)21)14-8-10-23-11-9-14/h4-11H,12H2,1-3H3,(H,24,26)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392819
PNG
(US10301306, Example 17)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1cncnc1
Show InChI InChI=1S/C25H17F2N5O/c26-19-4-1-15(2-5-19)22-23-21(7-8-31-25(23)33)32(24(22)18-11-29-14-30-12-18)13-16-3-6-20(27)9-17(16)10-28/h1-6,9,11-12,14H,7-8,13H2,(H,31,33)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392841
PNG
(US10301306, Example 39)
Show SMILES CC(C)(C)c1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccc(F)cc2)cc1
Show InChI InChI=1S/C29H28FN3O/c1-29(2,3)22-8-4-19(5-9-22)18-33-24-14-17-32-28(34)26(24)25(20-6-10-23(30)11-7-20)27(33)21-12-15-31-16-13-21/h4-13,15-16H,14,17-18H2,1-3H3,(H,32,34)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392884
PNG
(US10301306, Example 82)
Show SMILES OCCn1c2CCNC(=O)c2c(c1-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H18FN3O2/c21-15-3-1-13(2-4-15)17-18-16(7-10-23-20(18)26)24(11-12-25)19(17)14-5-8-22-9-6-14/h1-6,8-9,25H,7,10-12H2,(H,23,26)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392887
PNG
(US10301306, Example 85)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(CC2CCOCC2)c1-c1ccnc(NC(=O)c2ccncc2)c1
Show InChI InChI=1S/C30H28FN5O3/c31-23-3-1-20(2-4-23)26-27-24(8-14-34-30(27)38)36(18-19-9-15-39-16-10-19)28(26)22-7-13-33-25(17-22)35-29(37)21-5-11-32-12-6-21/h1-7,11-13,17,19H,8-10,14-16,18H2,(H,34,38)(H,33,35,37)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392982
PNG
(US10301306, Example 180)
Show SMILES Cc1cc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2cccc(CCc3ccccc3)c2)n(C)n1
Show InChI InChI=1S/C32H31N5O/c1-22-19-27(36(2)35-22)21-37-28-15-18-34-32(38)30(28)29(31(37)25-13-16-33-17-14-25)26-10-6-9-24(20-26)12-11-23-7-4-3-5-8-23/h3-10,13-14,16-17,19-20H,11-12,15,18,21H2,1-2H3,(H,34,38)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392895
PNG
(US10301306, Example 93 | US10301306, Example 98)
Show SMILES CC(C)CC(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1CC1CCOCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C29H33FN4O3/c1-18(2)15-25(35)33-24-16-21(7-11-31-24)28-26(20-3-5-22(30)6-4-20)27-23(8-12-32-29(27)36)34(28)17-19-9-13-37-14-10-19/h3-7,11,16,18-19H,8-10,12-15,17H2,1-2H3,(H,32,36)(H,31,33,35)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392896
PNG
(US10301306, Example 94)
Show SMILES CCCC(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1CC1CCOCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C28H31FN4O3/c1-2-3-24(34)32-23-16-20(8-12-30-23)27-25(19-4-6-21(29)7-5-19)26-22(9-13-31-28(26)35)33(27)17-18-10-14-36-15-11-18/h4-8,12,16,18H,2-3,9-11,13-15,17H2,1H3,(H,31,35)(H,30,32,34)
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US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392898
PNG
(US10301306, Example 96)
Show SMILES CNC(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1CC1CCOCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C26H28FN5O3/c1-28-26(34)31-21-14-18(6-10-29-21)24-22(17-2-4-19(27)5-3-17)23-20(7-11-30-25(23)33)32(24)15-16-8-12-35-13-9-16/h2-6,10,14,16H,7-9,11-13,15H2,1H3,(H,30,33)(H2,28,29,31,34)
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US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392906
PNG
(US10301306, Example 104)
Show SMILES COc1ccc(cc1)-c1c2c(CCNC2=O)n(CC2CCOCC2)c1-c1ccncc1
Show InChI InChI=1S/C25H27N3O3/c1-30-20-4-2-18(3-5-20)22-23-21(8-13-27-25(23)29)28(16-17-9-14-31-15-10-17)24(22)19-6-11-26-12-7-19/h2-7,11-12,17H,8-10,13-16H2,1H3,(H,27,29)
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US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392908
PNG
(US10301306, Example 106)
Show SMILES CC(=O)Nc1cccc(c1)-c1c2c(CCNC2=O)n(CC2CCOCC2)c1-c1ccncc1
Show InChI InChI=1S/C26H28N4O3/c1-17(31)29-21-4-2-3-20(15-21)23-24-22(7-12-28-26(24)32)30(16-18-8-13-33-14-9-18)25(23)19-5-10-27-11-6-19/h2-6,10-11,15,18H,7-9,12-14,16H2,1H3,(H,28,32)(H,29,31)
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US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392924
PNG
(US10301306, Example 122)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccc(OC(F)(F)F)cc2)c(c1)C#N
Show InChI InChI=1S/C27H18F4N4O2/c28-20-4-1-18(19(13-20)14-32)15-35-22-9-12-34-26(36)24(22)23(25(35)17-7-10-33-11-8-17)16-2-5-21(6-3-16)37-27(29,30)31/h1-8,10-11,13H,9,12,15H2,(H,34,36)
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US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392928
PNG
(US10301306, Example 126)
Show SMILES CS(=O)(=O)c1cccc(c1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccncc1
Show InChI InChI=1S/C27H21FN4O3S/c1-36(34,35)22-4-2-3-18(14-22)24-25-23(9-12-31-27(25)33)32(26(24)17-7-10-30-11-8-17)16-19-5-6-21(28)13-20(19)15-29/h2-8,10-11,13-14H,9,12,16H2,1H3,(H,31,33)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392934
PNG
(US10301306, Example 132)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2cncc3ccccc23)c(c1)C#N
Show InChI InChI=1S/C29H20FN5O/c30-22-6-5-20(21(13-22)14-31)17-35-25-9-12-34-29(36)27(25)26(28(35)18-7-10-32-11-8-18)24-16-33-15-19-3-1-2-4-23(19)24/h1-8,10-11,13,15-16H,9,12,17H2,(H,34,36)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392970
PNG
(US10301306, Example 168)
Show SMILES Cc1cc(ccn1)-c1c2c(CCNC2=O)n(Cc2ccc(Cl)cc2F)c1-c1ccncc1
Show InChI InChI=1S/C25H20ClFN4O/c1-15-12-17(6-10-29-15)22-23-21(7-11-30-25(23)32)31(24(22)16-4-8-28-9-5-16)14-18-2-3-19(26)13-20(18)27/h2-6,8-10,12-13H,7,11,14H2,1H3,(H,30,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392976
PNG
(US10301306, Example 174)
Show SMILES Cc1cc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2cccc(N)c2)n(C)n1
Show InChI InChI=1S/C24H24N6O/c1-15-12-19(29(2)28-15)14-30-20-8-11-27-24(31)22(20)21(17-4-3-5-18(25)13-17)23(30)16-6-9-26-10-7-16/h3-7,9-10,12-13H,8,11,14,25H2,1-2H3,(H,27,31)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392820
PNG
(US10301306, Example 18)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccnc(F)c1
Show InChI InChI=1S/C26H17F3N4O/c27-19-4-1-15(2-5-19)23-24-21(8-10-32-26(24)34)33(25(23)16-7-9-31-22(29)12-16)14-17-3-6-20(28)11-18(17)13-30/h1-7,9,11-12H,8,10,14H2,(H,32,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392823
PNG
(US10301306, Example 21)
Show SMILES CC(=O)Nc1cccc(c1)-c1c(c2c(CCNC2=O)n1Cc1ccc(F)cc1C#N)-c1ccc(F)cc1
Show InChI InChI=1S/C29H22F2N4O2/c1-17(36)34-24-4-2-3-19(14-24)28-26(18-5-8-22(30)9-6-18)27-25(11-12-33-29(27)37)35(28)16-20-7-10-23(31)13-21(20)15-32/h2-10,13-14H,11-12,16H2,1H3,(H,33,37)(H,34,36)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392863
PNG
(US10301306, Example 61)
Show SMILES CC(C)(C)Cn1c2CCNC(=O)c2c(c1-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C23H24FN3O/c1-23(2,3)14-27-18-10-13-26-22(28)20(18)19(15-4-6-17(24)7-5-15)21(27)16-8-11-25-12-9-16/h4-9,11-12H,10,13-14H2,1-3H3,(H,26,28)
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Bristol-Myers Squibb Company

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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392865
PNG
(US10301306, Example 63)
Show SMILES CCC(C)n1c2CCNC(=O)c2c(c1-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C22H22FN3O/c1-3-14(2)26-18-10-13-25-22(27)20(18)19(15-4-6-17(23)7-5-15)21(26)16-8-11-24-12-9-16/h4-9,11-12,14H,3,10,13H2,1-2H3,(H,25,27)
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Bristol-Myers Squibb Company

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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392874
PNG
(US10301306, Example 72)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccncn2)c1-c1ccncc1
Show InChI InChI=1S/C23H18FN5O/c24-17-3-1-15(2-4-17)20-21-19(8-12-27-23(21)30)29(13-18-7-11-26-14-28-18)22(20)16-5-9-25-10-6-16/h1-7,9-11,14H,8,12-13H2,(H,27,30)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392983
PNG
(US10301306, Example 181)
Show SMILES Cc1cc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2cccc(CCC3CCCCC3)c2)n(C)n1
Show InChI InChI=1S/C32H37N5O/c1-22-19-27(36(2)35-22)21-37-28-15-18-34-32(38)30(28)29(31(37)25-13-16-33-17-14-25)26-10-6-9-24(20-26)12-11-23-7-4-3-5-8-23/h6,9-10,13-14,16-17,19-20,23H,3-5,7-8,11-12,15,18,21H2,1-2H3,(H,34,38)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392899
PNG
(US10301306, Example 97)
Show SMILES CCNC(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1CC1CCOCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C27H30FN5O3/c1-2-29-27(35)32-22-15-19(7-11-30-22)25-23(18-3-5-20(28)6-4-18)24-21(8-12-31-26(24)34)33(25)16-17-9-13-36-14-10-17/h3-7,11,15,17H,2,8-10,12-14,16H2,1H3,(H,31,34)(H2,29,30,32,35)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392913
PNG
(US10301306, Example 111)
Show SMILES O=C1NCCc2c1c(c(-c1ccncc1)n2CC1CCOCC1)-c1cnc2ccccc2c1
Show InChI InChI=1S/C27H26N4O2/c32-27-25-23(7-12-29-27)31(17-18-8-13-33-14-9-18)26(19-5-10-28-11-6-19)24(25)21-15-20-3-1-2-4-22(20)30-16-21/h1-6,10-11,15-16,18H,7-9,12-14,17H2,(H,29,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392807
PNG
(3-([1,1′-Biphenyl]-3-yl)-2-(pyridin-4-yl)-1-...)
Show SMILES O=C1NCCc2c1c(c(-c1ccncc1)n2CC1CCOCC1)-c1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C30H29N3O2/c34-30-28-26(11-16-32-30)33(20-21-12-17-35-18-13-21)29(23-9-14-31-15-10-23)27(28)25-8-4-7-24(19-25)22-5-2-1-3-6-22/h1-10,14-15,19,21H,11-13,16-18,20H2,(H,32,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392809
PNG
(N-(4-(1-(2-Fluoro-4-(trifluoromethyl)benzyl)-3-(4-...)
Show SMILES CC(C)C(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(cc1F)C(F)(F)F)-c1ccc(F)cc1
Show InChI InChI=1S/C30H25F5N4O2/c1-16(2)28(40)38-24-13-18(9-11-36-24)27-25(17-4-7-21(31)8-5-17)26-23(10-12-37-29(26)41)39(27)15-19-3-6-20(14-22(19)32)30(33,34)35/h3-9,11,13-14,16H,10,12,15H2,1-2H3,(H,37,41)(H,36,38,40)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392824
PNG
(US10301306, Example 22)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccnc(Cl)c1
Show InChI InChI=1S/C26H17ClF2N4O/c27-22-12-16(7-9-31-22)25-23(15-1-4-19(28)5-2-15)24-21(8-10-32-26(24)34)33(25)14-17-3-6-20(29)11-18(17)13-30/h1-7,9,11-12H,8,10,14H2,(H,32,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392826
PNG
(US10301306, Example 24)
Show SMILES Cn1cc(cn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(F)cc1C#N)-c1ccc(F)cc1
Show InChI InChI=1S/C25H19F2N5O/c1-31-13-18(12-30-31)24-22(15-2-5-19(26)6-3-15)23-21(8-9-29-25(23)33)32(24)14-16-4-7-20(27)10-17(16)11-28/h2-7,10,12-13H,8-9,14H2,1H3,(H,29,33)
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US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392833
PNG
(US10301306, Example 31)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(CC2CCOCC2)c1-c1ccncc1
Show InChI InChI=1S/C24H24FN3O2/c25-19-3-1-17(2-4-19)21-22-20(7-12-27-24(22)29)28(15-16-8-13-30-14-9-16)23(21)18-5-10-26-11-6-18/h1-6,10-11,16H,7-9,12-15H2,(H,27,29)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392842
PNG
(US10301306, Example 40)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2ccc(OC(F)(F)F)c(Cl)c2)c1-c1ccncc1
Show InChI InChI=1S/C26H18ClF4N3O2/c27-19-13-15(1-6-21(19)36-26(29,30)31)14-34-20-9-12-33-25(35)23(20)22(16-2-4-18(28)5-3-16)24(34)17-7-10-32-11-8-17/h1-8,10-11,13H,9,12,14H2,(H,33,35)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392849
PNG
(US10301306, Example 47)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(Cc2nnc(s2)C2CC2)c1-c1ccncc1
Show InChI InChI=1S/C24H20FN5OS/c25-17-5-3-14(4-6-17)20-21-18(9-12-27-23(21)31)30(22(20)15-7-10-26-11-8-15)13-19-28-29-24(32-19)16-1-2-16/h3-8,10-11,16H,1-2,9,12-13H2,(H,27,31)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392861
PNG
(US10301306, Example 59)
Show SMILES Fc1ccc(cc1)-c1c2c(CCNC2=O)n(CCCC#N)c1-c1ccncc1
Show InChI InChI=1S/C22H19FN4O/c23-17-5-3-15(4-6-17)19-20-18(9-13-26-22(20)28)27(14-2-1-10-24)21(19)16-7-11-25-12-8-16/h3-8,11-12H,1-2,9,13-14H2,(H,26,28)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392882
PNG
(US10301306, Example 80)
Show SMILES Cn1ccnc1Cn1c2CCNC(=O)c2c(c1-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C23H20FN5O/c1-28-13-12-26-19(28)14-29-18-8-11-27-23(30)21(18)20(15-2-4-17(24)5-3-15)22(29)16-6-9-25-10-7-16/h2-7,9-10,12-13H,8,11,14H2,1H3,(H,27,30)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392979
PNG
(US10301306, Example 177)
Show SMILES Cc1cc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2cccc(NC(=O)C3CC3)c2)n(C)n1
Show InChI InChI=1S/C28H28N6O2/c1-17-14-22(33(2)32-17)16-34-23-10-13-30-28(36)25(23)24(26(34)18-8-11-29-12-9-18)20-4-3-5-21(15-20)31-27(35)19-6-7-19/h3-5,8-9,11-12,14-15,19H,6-7,10,13,16H2,1-2H3,(H,30,36)(H,31,35)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392904
PNG
(US10301306, Example 102)
Show SMILES CC(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(cc1)C(F)(F)F)-c1ccc(F)cc1
Show InChI InChI=1S/C28H22F4N4O2/c1-16(37)35-23-14-19(10-12-33-23)26-24(18-4-8-21(29)9-5-18)25-22(11-13-34-27(25)38)36(26)15-17-2-6-20(7-3-17)28(30,31)32/h2-10,12,14H,11,13,15H2,1H3,(H,34,38)(H,33,35,37)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392907
PNG
(US10301306, Example 105)
Show SMILES FC(F)(F)c1cccc(c1)-c1c2c(CCNC2=O)n(CC2CCOCC2)c1-c1ccncc1
Show InChI InChI=1S/C25H24F3N3O2/c26-25(27,28)19-3-1-2-18(14-19)21-22-20(6-11-30-24(22)32)31(15-16-7-12-33-13-8-16)23(21)17-4-9-29-10-5-17/h1-5,9-10,14,16H,6-8,11-13,15H2,(H,30,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392914
PNG
(US10301306, Example 112)
Show SMILES O=C1NCCc2c1c(c(-c1ccncc1)n2CC1CCOCC1)-c1cccc2ccncc12
Show InChI InChI=1S/C27H26N4O2/c32-27-25-23(7-13-30-27)31(17-18-8-14-33-15-9-18)26(20-5-10-28-11-6-20)24(25)21-3-1-2-19-4-12-29-16-22(19)21/h1-6,10-12,16,18H,7-9,13-15,17H2,(H,30,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392933
PNG
(US10301306, Example 131)
Show SMILES COc1ccncc1-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccncc1
Show InChI InChI=1S/C26H20FN5O2/c1-34-22-7-10-30-14-20(22)23-24-21(6-11-31-26(24)33)32(25(23)16-4-8-29-9-5-16)15-17-2-3-19(27)12-18(17)13-28/h2-5,7-10,12,14H,6,11,15H2,1H3,(H,31,33)
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Bristol-Myers Squibb Company

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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392945
PNG
(US10301306, Example 143)
Show SMILES Cc1cscc1-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccncc1
Show InChI InChI=1S/C25H19FN4OS/c1-15-13-32-14-20(15)22-23-21(6-9-29-25(23)31)30(24(22)16-4-7-28-8-5-16)12-17-2-3-19(26)10-18(17)11-27/h2-5,7-8,10,13-14H,6,9,12H2,1H3,(H,29,31)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392967
PNG
(US10301306, Example 165)
Show SMILES Cn1cc(cn1)-c1c2c(CCNC2=O)n(Cc2ccc(Cl)cc2F)c1-c1ccncc1
Show InChI InChI=1S/C23H19ClFN5O/c1-29-12-16(11-28-29)20-21-19(6-9-27-23(21)31)30(22(20)14-4-7-26-8-5-14)13-15-2-3-17(24)10-18(15)25/h2-5,7-8,10-12H,6,9,13H2,1H3,(H,27,31)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392969
PNG
(US10301306, Example 167)
Show SMILES COC(=O)c1cccc(c1)-c1c2c(CCNC2=O)n(Cc2ccc(Cl)cc2F)c1-c1ccncc1
Show InChI InChI=1S/C27H21ClFN3O3/c1-35-27(34)18-4-2-3-17(13-18)23-24-22(9-12-31-26(24)33)32(25(23)16-7-10-30-11-8-16)15-19-5-6-20(28)14-21(19)29/h2-8,10-11,13-14H,9,12,15H2,1H3,(H,31,33)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392971
PNG
(US10301306, Example 169)
Show SMILES Nc1cccc(c1)-c1c2c(CCNC2=O)n(Cc2ccc(Cl)cc2F)c1-c1ccncc1
Show InChI InChI=1S/C25H20ClFN4O/c26-18-5-4-17(20(27)13-18)14-31-21-8-11-30-25(32)23(21)22(16-2-1-3-19(28)12-16)24(31)15-6-9-29-10-7-15/h1-7,9-10,12-13H,8,11,14,28H2,(H,30,32)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392972
PNG
(US10301306, Example 170)
Show SMILES CCCC(=O)Nc1cccc(c1)-c1c2c(CCNC2=O)n(Cc2ccc(Cl)cc2F)c1-c1ccncc1
Show InChI InChI=1S/C29H26ClFN4O2/c1-2-4-25(36)34-22-6-3-5-19(15-22)26-27-24(11-14-33-29(27)37)35(28(26)18-9-12-32-13-10-18)17-20-7-8-21(30)16-23(20)31/h3,5-10,12-13,15-16H,2,4,11,14,17H2,1H3,(H,33,37)(H,34,36)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392838
PNG
(US10301306, Example 36)
Show SMILES CC(c1ccccc1)n1c2CCNC(=O)c2c(c1-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C26H22FN3O/c1-17(18-5-3-2-4-6-18)30-22-13-16-29-26(31)24(22)23(19-7-9-21(27)10-8-19)25(30)20-11-14-28-15-12-20/h2-12,14-15,17H,13,16H2,1H3,(H,29,31)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392864
PNG
(US10301306, Example 62)
Show SMILES CCn1c2CCNC(=O)c2c(c1-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C20H18FN3O/c1-2-24-16-9-12-23-20(25)18(16)17(13-3-5-15(21)6-4-13)19(24)14-7-10-22-11-8-14/h3-8,10-11H,2,9,12H2,1H3,(H,23,25)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392977
PNG
(US10301306, Example 175)
Show SMILES Cc1cc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2cccc(NC(=O)Cc3ccccc3)c2)n(C)n1
Show InChI InChI=1S/C32H30N6O2/c1-21-17-26(37(2)36-21)20-38-27-13-16-34-32(40)30(27)29(31(38)23-11-14-33-15-12-23)24-9-6-10-25(19-24)35-28(39)18-22-7-4-3-5-8-22/h3-12,14-15,17,19H,13,16,18,20H2,1-2H3,(H,34,40)(H,35,39)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392814
PNG
(2-(2-Aminopyridin-4-yl)-1-(2-fluoro-4-(trifluorome...)
Show SMILES Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1Cc1ccc(cc1F)C(F)(F)F)-c1ccc(F)cc1
Show InChI InChI=1S/C26H19F5N4O/c27-18-5-2-14(3-6-18)22-23-20(8-10-34-25(23)36)35(24(22)15-7-9-33-21(32)11-15)13-16-1-4-17(12-19(16)28)26(29,30)31/h1-7,9,11-12H,8,10,13H2,(H2,32,33)(H,34,36)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392891
PNG
(US10301306, Example 89)
Show SMILES COc1ccc(cc1)C(=O)Nc1cc(ccn1)-c1c(c2c(CCNC2=O)n1CC1CCOCC1)-c1ccc(F)cc1
Show InChI InChI=1S/C32H31FN4O4/c1-40-25-8-4-22(5-9-25)31(38)36-27-18-23(10-14-34-27)30-28(21-2-6-24(33)7-3-21)29-26(11-15-35-32(29)39)37(30)19-20-12-16-41-17-13-20/h2-10,14,18,20H,11-13,15-17,19H2,1H3,(H,35,39)(H,34,36,38)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392978
PNG
(US10301306, Example 176)
Show SMILES Cc1cc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2cccc(NC(=O)c3ccccc3)c2)n(C)n1
Show InChI InChI=1S/C31H28N6O2/c1-20-17-25(36(2)35-20)19-37-26-13-16-33-31(39)28(26)27(29(37)21-11-14-32-15-12-21)23-9-6-10-24(18-23)34-30(38)22-7-4-3-5-8-22/h3-12,14-15,17-18H,13,16,19H2,1-2H3,(H,33,39)(H,34,38)
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Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392980
PNG
(US10301306, Example 178)
Show SMILES Cc1cc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2cccc(NC=O)c2)n(C)n1
Show InChI InChI=1S/C25H24N6O2/c1-16-12-20(30(2)29-16)14-31-21-8-11-27-25(33)23(21)22(24(31)17-6-9-26-10-7-17)18-4-3-5-19(13-18)28-15-32/h3-7,9-10,12-13,15H,8,11,14H2,1-2H3,(H,27,33)(H,28,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392912
PNG
(US10301306, Example 110)
Show SMILES FC(F)(F)Oc1cccc(c1)-c1c2c(CCNC2=O)n(CC2CCOCC2)c1-c1ccncc1
Show InChI InChI=1S/C25H24F3N3O3/c26-25(27,28)34-19-3-1-2-18(14-19)21-22-20(6-11-30-24(22)32)31(15-16-7-12-33-13-8-16)23(21)17-4-9-29-10-5-17/h1-5,9-10,14,16H,6-8,11-13,15H2,(H,30,32)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392915
PNG
(US10301306, Example 113)
Show SMILES COc1ccc(cc1OC)-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccncc1
Show InChI InChI=1S/C28H23FN4O3/c1-35-23-6-4-18(14-24(23)36-2)25-26-22(9-12-32-28(26)34)33(27(25)17-7-10-31-11-8-17)16-19-3-5-21(29)13-20(19)15-30/h3-8,10-11,13-14H,9,12,16H2,1-2H3,(H,32,34)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392922
PNG
(US10301306, Example 120)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2cccc(c2)-c2ccccc2)c(c1)C#N
Show InChI InChI=1S/C32H23FN4O/c33-27-10-9-25(26(18-27)19-34)20-37-28-13-16-36-32(38)30(28)29(31(37)22-11-14-35-15-12-22)24-8-4-7-23(17-24)21-5-2-1-3-6-21/h1-12,14-15,17-18H,13,16,20H2,(H,36,38)
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US Patent


Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392927
PNG
(US10301306, Example 125)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccccc2-c2ccccc2)c(c1)C#N
Show InChI InChI=1S/C32H23FN4O/c33-25-11-10-23(24(18-25)19-34)20-37-28-14-17-36-32(38)30(28)29(31(37)22-12-15-35-16-13-22)27-9-5-4-8-26(27)21-6-2-1-3-7-21/h1-13,15-16,18H,14,17,20H2,(H,36,38)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

More data for this
Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392937
PNG
(US10301306, Example 135)
Show SMILES Fc1ccc(Cn2c3CCNC(=O)c3c(c2-c2ccncc2)-c2ccc(OCc3ccccc3)cc2)c(c1)C#N
Show InChI InChI=1S/C33H25FN4O2/c34-27-9-6-25(26(18-27)19-35)20-38-29-14-17-37-33(39)31(29)30(32(38)24-12-15-36-16-13-24)23-7-10-28(11-8-23)40-21-22-4-2-1-3-5-22/h1-13,15-16,18H,14,17,20-21H2,(H,37,39)
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Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...


US Patent US10301306 (2019)

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