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Patent code US9868720

Compile Data Set for Download or QSAR
Found 93 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
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365304
PNG
((2-Methoxy-4-methyl- phenyl)-{3-[6-(4-methyl- pyri...)
Show SMILES COc1cc(C)ccc1C(=O)N1CCCC(C1)c1cc(Nc2cc(C)ccn2)nc(n1)N1CCCC1C
Show InChI InChI=1/C29H36N6O2/c1-19-9-10-23(25(15-19)37-4)28(36)34-13-6-8-22(18-34)24-17-27(32-26-16-20(2)11-12-30-26)33-29(31-24)35-14-5-7-21(35)3/h9-12,15-17,21-22H,5-8,13-14,18H2,1-4H3,(H,30,31,32,33)
PDB

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US Patent
0.170n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365250
PNG
(US9868720, No. 169 | [6-(1-Methyl-piperidin- 4-yl)...)
Show SMILES C[C@@H]1CCCN1c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCN(C)CC1
Show InChI InChI=1/C21H27F3N6/c1-14-4-3-9-30(14)20-26-17(15-6-10-29(2)11-7-15)13-19(28-20)27-18-12-16(5-8-25-18)21(22,23)24/h5,8,12-15H,3-4,6-7,9-11H2,1-2H3,(H,25,26,27,28)/t14-/s2
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0.400n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365305
PNG
(US9868720, No. 426 | {3-[2-(3,3-Difluoro- pyrroli...)
Show SMILES COc1cc(C)ccc1C(=O)N1CCCC(C1)c1cc(Nc2cc(C)ccn2)nc(n1)N1CCC(F)(F)C1
Show InChI InChI=1/C28H32F2N6O2/c1-18-6-7-21(23(13-18)38-3)26(37)35-11-4-5-20(16-35)22-15-25(33-24-14-19(2)8-10-31-24)34-27(32-22)36-12-9-28(29,30)17-36/h6-8,10,13-15,20H,4-5,9,11-12,16-17H2,1-3H3,(H,31,32,33,34)
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0.5n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365231
PNG
(US9868720, No. 65 | [2-(2-Methyl-pyrrolidin- 1-yl)...)
Show SMILES CC1CCCN1c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCNCC1
Show InChI InChI=1/C20H25F3N6/c1-13-3-2-10-29(13)19-26-16(14-4-7-24-8-5-14)12-18(28-19)27-17-11-15(6-9-25-17)20(21,22)23/h6,9,11-14,24H,2-5,7-8,10H2,1H3,(H,25,26,27,28)
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0.735n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365240
PNG
(US9868720, No. 111 | [2-((R)-2-Methyl-pyrrolidin- ...)
Show SMILES C[C@@H]1CCCN1c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCNCC1
Show InChI InChI=1/C20H25F3N6/c1-13-3-2-10-29(13)19-26-16(14-4-7-24-8-5-14)12-18(28-19)27-17-11-15(6-9-25-17)20(21,22)23/h6,9,11-14,24H,2-5,7-8,10H2,1H3,(H,25,26,27,28)/t13-/s2
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0.850n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365260
PNG
((4-Cyclopropyl-pyridin- 2-yl)-[2-((R)-2-methyl- py...)
Show SMILES C[C@@H]1CCCN1c1nc(Nc2cc(ccn2)C2CC2)cc(n1)C1CCNCC1
Show InChI InChI=1/C22H30N6/c1-15-3-2-12-28(15)22-25-19(17-6-9-23-10-7-17)14-21(27-22)26-20-13-18(8-11-24-20)16-4-5-16/h8,11,13-17,23H,2-7,9-10,12H2,1H3,(H,24,25,26,27)/t15-/s2
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0.950n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365261
PNG
(2-Imidazol-1-yl-1-{3-[2- (2-methyl-pyrrolidin-1- y...)
Show SMILES CC1CCCN1c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCN(C1)C(=O)Cn1ccnc1
Show InChI InChI=1/C24H27F3N8O/c1-16-3-2-8-35(16)23-30-19(17-5-9-34(13-17)22(36)14-33-10-7-28-15-33)12-21(32-23)31-20-11-18(4-6-29-20)24(25,26)27/h4,6-7,10-12,15-17H,2-3,5,8-9,13-14H2,1H3,(H,29,30,31,32)
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US Patent
1.59n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365290
PNG
((1-Methyl-1H-imidazol- 4-yl)-{3-[2-(2-methyl- pyrr...)
Show SMILES CC1CCCN1c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCN(C1)C(=O)c1cn(C)cn1
Show InChI InChI=1/C24H27F3N8O/c1-15-4-3-8-35(15)23-30-18(16-6-9-34(12-16)22(36)19-13-33(2)14-29-19)11-21(32-23)31-20-10-17(5-7-28-20)24(25,26)27/h5,7,10-11,13-16H,3-4,6,8-9,12H2,1-2H3,(H,28,30,31,32)
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1.72n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365252
PNG
(1-{4-[2-((R)-2-Methyl- pyrrolidin-1-yl)-6-(4- trif...)
Show SMILES C[C@@H]1CCCN1c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCN(CC1)C(C)=O
Show InChI InChI=1/C22H27F3N6O/c1-14-4-3-9-31(14)21-27-18(16-6-10-30(11-7-16)15(2)32)13-20(29-21)28-19-12-17(5-8-26-19)22(23,24)25/h5,8,12-14,16H,3-4,6-7,9-11H2,1-2H3,(H,26,27,28,29)/t14-/s2
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2.20n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM50059205
PNG
(CHEMBL3393322 | US9868720, No. 92)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)N2CCC(F)(F)C2)C2CCNCC2)c1
Show InChI InChI=1S/C19H21F5N6/c20-18(21)4-8-30(11-18)17-27-14(12-1-5-25-6-2-12)10-16(29-17)28-15-9-13(3-7-26-15)19(22,23)24/h3,7,9-10,12,25H,1-2,4-6,8,11H2,(H,26,27,28,29)
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Similars

US Patent
2.43n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365237
PNG
(US9868720, No. 96 | [2-(3,3-Difluoro-piperidin- 1-...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)N2CCCC(F)(F)C2)C2CCNC2)c1
Show InChI InChI=1/C19H21F5N6/c20-18(21)4-1-7-30(11-18)17-27-14(12-2-5-25-10-12)9-16(29-17)28-15-8-13(3-6-26-15)19(22,23)24/h3,6,8-9,12,25H,1-2,4-5,7,10-11H2,(H,26,27,28,29)
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3.10n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365259
PNG
(US9868720, No. 201 | [2-(3,3-Difluoro-pyrrolidin- ...)
Show SMILES FC1(F)CCN(C1)c1nc(Nc2cc(ccn2)-c2cccs2)cc(n1)C1CCNCC1
Show InChI InChI=1S/C22H24F2N6S/c23-22(24)6-10-30(14-22)21-27-17(15-3-7-25-8-4-15)13-20(29-21)28-19-12-16(5-9-26-19)18-2-1-11-31-18/h1-2,5,9,11-13,15,25H,3-4,6-8,10,14H2,(H,26,27,28,29)
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3.20n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365248
PNG
(US9868720, No. 160 | [2-(3,3-Difluoro-pyrrolidin- ...)
Show SMILES CN1CCC(CC1)c1cc(Nc2cc(ccn2)C(F)(F)F)nc(n1)N1CCC(F)(F)C1
Show InChI InChI=1S/C20H23F5N6/c1-30-7-3-13(4-8-30)15-11-17(28-16-10-14(2-6-26-16)20(23,24)25)29-18(27-15)31-9-5-19(21,22)12-31/h2,6,10-11,13H,3-5,7-9,12H2,1H3,(H,26,27,28,29)
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4.42n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365232
PNG
((2-Pyrrolidin-1-yl-6-pyr- rolidin-3-yl-pyrimidin- ...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)N2CCCC2)C2CCNC2)c1
Show InChI InChI=1/C18H21F3N6/c19-18(20,21)13-4-6-23-15(9-13)25-16-10-14(12-3-5-22-11-12)24-17(26-16)27-7-1-2-8-27/h4,6,9-10,12,22H,1-3,5,7-8,11H2,(H,23,24,25,26)
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4.80n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365298
PNG
(US9868720, No. 404 | {2-(3,3-Difluoro-pyrrolidin- ...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)N2CCC(F)(F)C2)C2CCN(Cc3cn[nH]c3)C2)c1
Show InChI InChI=1/C22H23F5N8/c23-21(24)3-6-35(13-21)20-31-17(15-2-5-34(12-15)11-14-9-29-30-10-14)8-19(33-20)32-18-7-16(1-4-28-18)22(25,26)27/h1,4,7-10,15H,2-3,5-6,11-13H2,(H,29,30)(H,28,31,32,33)
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4.92n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365302
PNG
(US9868720, No. 423 | {2-(1-Methyl-1H-pyrazol- 4-yl...)
Show SMILES Cn1cc(cn1)-c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCN(CC2CCOCC2)C1
Show InChI InChI=1/C24H28F3N7O/c1-33-14-18(12-29-33)23-30-20(17-3-7-34(15-17)13-16-4-8-35-9-5-16)11-22(32-23)31-21-10-19(2-6-28-21)24(25,26)27/h2,6,10-12,14,16-17H,3-5,7-9,13,15H2,1H3,(H,28,30,31,32)
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5.21n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365281
PNG
(1-Methyl-4-[2-(2-methyl- pyrrolidin-1-yl)-6-(4- tr...)
Show SMILES CC1CCCN1c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCN(C)C(=O)C1
Show InChI InChI=1/C21H25F3N6O/c1-13-4-3-8-30(13)20-26-16(14-6-9-29(2)19(31)10-14)12-18(28-20)27-17-11-15(5-7-25-17)21(22,23)24/h5,7,11-14H,3-4,6,8-10H2,1-2H3,(H,25,26,27,28)
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6.12n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365261
PNG
(2-Imidazol-1-yl-1-{3-[2- (2-methyl-pyrrolidin-1- y...)
Show SMILES CC1CCCN1c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCN(C1)C(=O)Cn1ccnc1
Show InChI InChI=1/C24H27F3N8O/c1-16-3-2-8-35(16)23-30-19(17-5-9-34(13-17)22(36)14-33-10-7-28-15-33)12-21(32-23)31-20-11-18(4-6-29-20)24(25,26)27/h4,6-7,10-12,15-17H,2-3,5,8-9,13-14H2,1H3,(H,29,30,31,32)
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7.69n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365253
PNG
(3-{4-[2-(2-Methyl-pyrrolidin- 1-yl)-6-(4-trifluoro...)
Show SMILES CC1CCCN1c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCN(CC1)C(=O)CC#N
Show InChI InChI=1/C23H26F3N7O/c1-15-3-2-10-33(15)22-29-18(16-6-11-32(12-7-16)21(34)4-8-27)14-20(31-22)30-19-13-17(5-9-28-19)23(24,25)26/h5,9,13-16H,2-4,6-7,10-12H2,1H3,(H,28,29,30,31)
PDB

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8.03n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365258
PNG
((4-tert-Butyl-pyridin-2- yl)-[2-(3,3-difluoro- pyr...)
Show SMILES CC(C)(C)c1ccnc(Nc2cc(nc(n2)N2CCC(F)(F)C2)C2CCNCC2)c1
Show InChI InChI=1S/C22H30F2N6/c1-21(2,3)16-6-10-26-18(12-16)28-19-13-17(15-4-8-25-9-5-15)27-20(29-19)30-11-7-22(23,24)14-30/h6,10,12-13,15,25H,4-5,7-9,11,14H2,1-3H3,(H,26,27,28,29)
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8.34n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365242
PNG
((4-Chloro-pyridin-2-yl)- [2-(3,3-difluoro-pyrrolid...)
Show SMILES FC1(F)CCN(C1)c1nc(Nc2cc(Cl)ccn2)cc(n1)C1CCNCC1
Show InChI InChI=1S/C18H21ClF2N6/c19-13-3-7-23-15(9-13)25-16-10-14(12-1-5-22-6-2-12)24-17(26-16)27-8-4-18(20,21)11-27/h3,7,9-10,12,22H,1-2,4-6,8,11H2,(H,23,24,25,26)
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8.55n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365292
PNG
(US9868720, No. 388 | {2-(2-Methyl-2H-pyrazol- 3-yl...)
Show SMILES Cn1nccc1-c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCN(CC2CCOCC2)C1
Show InChI InChI=1/C24H28F3N7O/c1-33-20(3-8-29-33)23-30-19(17-4-9-34(15-17)14-16-5-10-35-11-6-16)13-22(32-23)31-21-12-18(2-7-28-21)24(25,26)27/h2-3,7-8,12-13,16-17H,4-6,9-11,14-15H2,1H3,(H,28,30,31,32)
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8.75n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365293
PNG
(US9868720, No. 391 | [2-Cyclopentyl-6-(1- oxetan-3...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)C2CCCC2)C2CCCN(C2)C2COC2)c1
Show InChI InChI=1/C23H28F3N5O/c24-23(25,26)17-7-8-27-20(10-17)29-21-11-19(28-22(30-21)15-4-1-2-5-15)16-6-3-9-31(12-16)18-13-32-14-18/h7-8,10-11,15-16,18H,1-6,9,12-14H2,(H,27,28,29,30)
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9n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365245
PNG
(US9868720, No. 143 | [2-((2R,5R)-2,5-Dimethyl- pyr...)
Show SMILES C[C@@H]1CC[C@@H](C)N1c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCNCC1
Show InChI InChI=1/C21H27F3N6/c1-13-3-4-14(2)30(13)20-27-17(15-5-8-25-9-6-15)12-19(29-20)28-18-11-16(7-10-26-18)21(22,23)24/h7,10-15,25H,3-6,8-9H2,1-2H3,(H,26,27,28,29)/t13-,14-/s2
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10.4n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365289
PNG
(1-{3-[2-((R)-2-Methyl- pyrrolidin-1-yl)-6-(4- trif...)
Show SMILES C[C@@H]1CCCN1c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CN(C1)C(C)=O
Show InChI InChI=1/C20H23F3N6O/c1-12-4-3-7-29(12)19-25-16(14-10-28(11-14)13(2)30)9-18(27-19)26-17-8-15(5-6-24-17)20(21,22)23/h5-6,8-9,12,14H,3-4,7,10-11H2,1-2H3,(H,24,25,26,27)/t12-/s2
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11.1n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365238
PNG
(4-[2-(3,3-Difluoro-pyr- rolidin-1-yl)-6-(4-trifluo...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)N2CCC(F)(F)C2)C2(CCNCC2)C#N)c1
Show InChI InChI=1S/C20H20F5N7/c21-19(22)4-8-32(12-19)17-29-14(18(11-26)2-6-27-7-3-18)10-16(31-17)30-15-9-13(1-5-28-15)20(23,24)25/h1,5,9-10,27H,2-4,6-8,12H2,(H,28,29,30,31)
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11.7n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365303
PNG
(1-{4-[2-(1-Methyl-1H- pyrazol-4-yl)-6-(4- trifluor...)
Show SMILES CC(=O)N1CCC(CC1)c1cc(Nc2cc(ccn2)C(F)(F)F)nc(n1)-c1cnn(C)c1
Show InChI InChI=1S/C21H22F3N7O/c1-13(32)31-7-4-14(5-8-31)17-10-19(29-20(27-17)15-11-26-30(2)12-15)28-18-9-16(3-6-25-18)21(22,23)24/h3,6,9-12,14H,4-5,7-8H2,1-2H3,(H,25,27,28,29)
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12.4n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365227
PNG
(2-{Methyl-[4-pyrrolidin- 3-yl-6-(4-trifluoromethyl...)
Show SMILES CN(CCO)c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCNC1
Show InChI InChI=1/C17H21F3N6O/c1-26(6-7-27)16-23-13(11-2-4-21-10-11)9-15(25-16)24-14-8-12(3-5-22-14)17(18,19)20/h3,5,8-9,11,21,27H,2,4,6-7,10H2,1H3,(H,22,23,24,25)
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12.6n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365243
PNG
((4-Methoxy-pyridin-2-yl)- [2-(2-methyl-pyrrolidin-...)
Show SMILES COc1ccnc(Nc2cc(nc(n2)N2CCCC2C)C2CCNCC2)c1
Show InChI InChI=1/C20H28N6O/c1-14-4-3-11-26(14)20-23-17(15-5-8-21-9-6-15)13-19(25-20)24-18-12-16(27-2)7-10-22-18/h7,10,12-15,21H,3-6,8-9,11H2,1-2H3,(H,22,23,24,25)
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15.2n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365249
PNG
(3-Oxo-3-{4-[2-pyrrolidin- 1-yl-6-(4-trifluoromethy...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)N2CCCC2)C2CCN(CC2)C(=O)CC#N)c1
Show InChI InChI=1S/C22H24F3N7O/c23-22(24,25)16-4-8-27-18(13-16)29-19-14-17(28-21(30-19)32-9-1-2-10-32)15-5-11-31(12-6-15)20(33)3-7-26/h4,8,13-15H,1-3,5-6,9-12H2,(H,27,28,29,30)
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15.3n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365241
PNG
(US9868720, No. 112 | [2-((S)-2-Methyl-pyrrolidin- ...)
Show SMILES C[C@H]1CCCN1c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCNCC1
Show InChI InChI=1/C20H25F3N6/c1-13-3-2-10-29(13)19-26-16(14-4-7-24-8-5-14)12-18(28-19)27-17-11-15(6-9-25-17)20(21,22)23/h6,9,11-14,24H,2-5,7-8,10H2,1H3,(H,25,26,27,28)/t13-/s2
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15.8n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365306
PNG
(N-(4-chloropyridin-2-yl)- 2-(3,3-difluoropyrrolidi...)
Show SMILES FC1(F)CCN(C1)c1nc(Nc2cc(Cl)ccn2)cc(n1)C1CCN(CC1)C1COC1
Show InChI InChI=1S/C21H25ClF2N6O/c22-15-1-5-25-18(9-15)27-19-10-17(14-2-6-29(7-3-14)16-11-31-12-16)26-20(28-19)30-8-4-21(23,24)13-30/h1,5,9-10,14,16H,2-4,6-8,11-13H2,(H,25,26,27,28)
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16n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365280
PNG
(1-Methyl-5-[2-((R)-2- methyl-pyrrolidin-1-yl)- 6-(...)
Show SMILES C[C@@H]1CCCN1c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)-c1ccc(=O)n(C)c1
Show InChI InChI=1/C21H21F3N6O/c1-13-4-3-9-30(13)20-26-16(14-5-6-19(31)29(2)12-14)11-18(28-20)27-17-10-15(7-8-25-17)21(22,23)24/h5-8,10-13H,3-4,9H2,1-2H3,(H,25,26,27,28)/t13-/s2
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18.4n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365223
PNG
((4-Methyl-pyridin-2-yl)- (6-piperidin-4-yl-2- pyrr...)
Show SMILES Cc1ccnc(Nc2cc(nc(n2)N2CCCC2)C2CCNCC2)c1
Show InChI InChI=1S/C19H26N6/c1-14-4-9-21-17(12-14)23-18-13-16(15-5-7-20-8-6-15)22-19(24-18)25-10-2-3-11-25/h4,9,12-13,15,20H,2-3,5-8,10-11H2,1H3,(H,21,22,23,24)
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20.5n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365218
PNG
(Synthesis of 1-(3-(2-(1-methyl-1H-pyrazol-4-yl)-6-...)
Show SMILES COc1cc(C)ccc1C(=O)N1CCCC(C1)c1cc(Nc2cc(C)ccn2)nc(C)n1
Show InChI InChI=1/C25H29N5O2/c1-16-7-8-20(22(12-16)32-4)25(31)30-11-5-6-19(15-30)21-14-24(28-18(3)27-21)29-23-13-17(2)9-10-26-23/h7-10,12-14,19H,5-6,11,15H2,1-4H3,(H,26,27,28,29)
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20.7n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365282
PNG
(US9868720, No. 348 | [2-(2-Ethyl-morpholin- 4-yl)-...)
Show SMILES CCC1CN(CCO1)c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCN(C)C1
Show InChI InChI=1/C21H27F3N6O/c1-3-16-13-30(8-9-31-16)20-26-17(14-5-7-29(2)12-14)11-19(28-20)27-18-10-15(4-6-25-18)21(22,23)24/h4,6,10-11,14,16H,3,5,7-9,12-13H2,1-2H3,(H,25,26,27,28)
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22.6n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365299
PNG
(US9868720, No. 407 | [2-Cyclobutyl-6-(1-oxetan- 3-...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)C2CCC2)C2CCCN(C2)C2COC2)c1
Show InChI InChI=1/C22H26F3N5O/c23-22(24,25)16-6-7-26-19(9-16)28-20-10-18(27-21(29-20)14-3-1-4-14)15-5-2-8-30(11-15)17-12-31-13-17/h6-7,9-10,14-15,17H,1-5,8,11-13H2,(H,26,27,28,29)
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26n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365266
PNG
(1-{4-[2-(3,4-Difluoro- pyrrolidin-1-yl)-6-(4- trif...)
Show SMILES CC(=O)N1CCC(CC1)c1cc(Nc2cc(ccn2)C(F)(F)F)nc(n1)N1CC(F)C(F)C1
Show InChI InChI=1/C21H23F5N6O/c1-12(33)31-6-3-13(4-7-31)17-9-19(29-18-8-14(2-5-27-18)21(24,25)26)30-20(28-17)32-10-15(22)16(23)11-32/h2,5,8-9,13,15-16H,3-4,6-7,10-11H2,1H3,(H,27,28,29,30)
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26.7n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365254
PNG
(1-{3-[2-(3,3-Difluoro- pyrrolidin-1-yl)-6-(4- trif...)
Show SMILES FC(F)C(=O)N1CCCC(C1)c1cc(Nc2cc(ccn2)C(F)(F)F)nc(n1)N1CCC(F)(F)C1
Show InChI InChI=1/C21H21F7N6O/c22-17(23)18(35)33-6-1-2-12(10-33)14-9-16(31-15-8-13(3-5-29-15)21(26,27)28)32-19(30-14)34-7-4-20(24,25)11-34/h3,5,8-9,12,17H,1-2,4,6-7,10-11H2,(H,29,30,31,32)
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26.8n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365247
PNG
(1-Acetyl-4-[2-(3,3- difluoro-pyrrolidin-1-yl)-6- (...)
Show SMILES CC(=O)N1CCC(CC1)(C#N)c1cc(Nc2cc(ccn2)C(F)(F)F)nc(n1)N1CCC(F)(F)C1
Show InChI InChI=1S/C22H22F5N7O/c1-14(35)33-7-3-20(12-28,4-8-33)16-11-18(31-17-10-15(2-6-29-17)22(25,26)27)32-19(30-16)34-9-5-21(23,24)13-34/h2,6,10-11H,3-5,7-9,13H2,1H3,(H,29,30,31,32)
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26.9n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365288
PNG
(US9868720, No. 374 | [6-(1-Methanesulfonyl- azetid...)
Show SMILES C[C@@H]1CCCN1c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CN(C1)S(C)(=O)=O
Show InChI InChI=1/C19H23F3N6O2S/c1-12-4-3-7-28(12)18-24-15(13-10-27(11-13)31(2,29)30)9-17(26-18)25-16-8-14(5-6-23-16)19(20,21)22/h5-6,8-9,12-13H,3-4,7,10-11H2,1-2H3,(H,23,24,25,26)/t12-/s2
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30.6n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365239
PNG
(1-{3-[6-(4-Methyl-pyridin- 2-ylamino)-2-phenyl- py...)
Show SMILES CC(=O)N1CCCC(C1)c1cc(Nc2cc(C)ccn2)nc(n1)-c1ccccc1
Show InChI InChI=1/C23H25N5O/c1-16-10-11-24-21(13-16)26-22-14-20(19-9-6-12-28(15-19)17(2)29)25-23(27-22)18-7-4-3-5-8-18/h3-5,7-8,10-11,13-14,19H,6,9,12,15H2,1-2H3,(H,24,25,26,27)
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30.7n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365279
PNG
(US9868720, No. 330 | [6-(1-Methanesulfonyl- piperi...)
Show SMILES C[C@@H]1CCCN1c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCN(CC1)S(C)(=O)=O
Show InChI InChI=1/C21H27F3N6O2S/c1-14-4-3-9-30(14)20-26-17(15-6-10-29(11-7-15)33(2,31)32)13-19(28-20)27-18-12-16(5-8-25-18)21(22,23)24/h5,8,12-15H,3-4,6-7,9-11H2,1-2H3,(H,25,26,27,28)/t14-/s2
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31.8n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365276
PNG
(US9868720, No. 307 | {2-(3,3-Difluoro-azetidin- 1-...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)N2CC(F)(F)C2)C2CCN(CC3CCOCC3)C2)c1
Show InChI InChI=1/C23H27F5N6O/c24-22(25)13-34(14-22)21-30-18(16-2-6-33(12-16)11-15-3-7-35-8-4-15)10-20(32-21)31-19-9-17(1-5-29-19)23(26,27)28/h1,5,9-10,15-16H,2-4,6-8,11-14H2,(H,29,30,31,32)
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31.9n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365291
PNG
(US9868720, No. 385 | [2-Cyclopentyl-6-(1- methanes...)
Show SMILES CS(=O)(=O)N1CCCC(C1)c1cc(Nc2cc(ccn2)C(F)(F)F)nc(n1)C1CCCC1
Show InChI InChI=1/C21H26F3N5O2S/c1-32(30,31)29-10-4-7-15(13-29)17-12-19(28-20(26-17)14-5-2-3-6-14)27-18-11-16(8-9-25-18)21(22,23)24/h8-9,11-12,14-15H,2-7,10,13H2,1H3,(H,25,26,27,28)
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36.8n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365251
PNG
(3-{3-[2-Cyclopropyl-6- (4-trifluoromethyl- pyridin...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)C2CC2)C2CCCN(C2)C(=O)CC#N)c1
Show InChI InChI=1/C21H21F3N6O/c22-21(23,24)15-6-8-26-17(10-15)28-18-11-16(27-20(29-18)13-3-4-13)14-2-1-9-30(12-14)19(31)5-7-25/h6,8,10-11,13-14H,1-5,9,12H2,(H,26,27,28,29)
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37n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365256
PNG
(Cyclopropyl-{3-[2-(3,3- difluoro-pyrrolidin-1-yl)-...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)N2CCC(F)(F)C2)C2CCN(C2)C(=O)C2CC2)c1
Show InChI InChI=1/C22H23F5N6O/c23-21(24)5-8-33(12-21)20-29-16(14-4-7-32(11-14)19(34)13-1-2-13)10-18(31-20)30-17-9-15(3-6-28-17)22(25,26)27/h3,6,9-10,13-14H,1-2,4-5,7-8,11-12H2,(H,28,29,30,31)
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41.5n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365262
PNG
(1-{4-[6-(4-Trifluoromethyl- pyridin-2-ylamino)- 2-...)
Show SMILES CC(=O)N1CCC(CC1)c1cc(Nc2cc(ccn2)C(F)(F)F)nc(n1)N1CCC(C1)C(F)(F)F
Show InChI InChI=1/C22H24F6N6O/c1-13(35)33-7-3-14(4-8-33)17-11-19(31-18-10-15(2-6-29-18)21(23,24)25)32-20(30-17)34-9-5-16(12-34)22(26,27)28/h2,6,10-11,14,16H,3-5,7-9,12H2,1H3,(H,29,30,31,32)
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43.3n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365268
PNG
(US9868720, No. 252 | [2-(3,4,6,7-Tetrahydro- imida...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)N2CCc3nc[nH]c3C2)C2CCOCC2)c1
Show InChI InChI=1S/C21H22F3N7O/c22-21(23,24)14-1-5-25-18(9-14)29-19-10-16(13-3-7-32-8-4-13)28-20(30-19)31-6-2-15-17(11-31)27-12-26-15/h1,5,9-10,12-13H,2-4,6-8,11H2,(H,26,27)(H,25,28,29,30)
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43.5n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365222
PNG
((4-Fluoro-phenyl)-{3-[2- methyl-6-(4-trifluoro- me...)
Show SMILES Cc1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCCN(C1)C(=O)c1ccc(F)cc1
Show InChI InChI=1/C23H21F4N5O/c1-14-29-19(12-21(30-14)31-20-11-17(8-9-28-20)23(25,26)27)16-3-2-10-32(13-16)22(33)15-4-6-18(24)7-5-15/h4-9,11-12,16H,2-3,10,13H2,1H3,(H,28,29,30,31)
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43.6n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365255
PNG
(US9868720, No. 180 | {3-[2-(3,3-Difluoro- pyrrolid...)
Show SMILES CC1CC1C(=O)N1CCC(C1)c1cc(Nc2cc(ccn2)C(F)(F)F)nc(n1)N1CCC(F)(F)C1
Show InChI InChI=1/C23H25F5N6O/c1-13-8-16(13)20(35)33-6-3-14(11-33)17-10-19(31-18-9-15(2-5-29-18)23(26,27)28)32-21(30-17)34-7-4-22(24,25)12-34/h2,5,9-10,13-14,16H,3-4,6-8,11-12H2,1H3,(H,29,30,31,32)
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46.2n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365272
PNG
(US9868720, No. 274 | [6-(1-Methyl-pyrrolidin- 3-yl...)
Show SMILES CN1CCC(C1)c1cc(Nc2cc(ccn2)C(F)(F)F)nc(n1)N1CC2CC1CO2
Show InChI InChI=1/C20H23F3N6O/c1-28-5-3-12(9-28)16-8-18(26-17-6-13(2-4-24-17)20(21,22)23)27-19(25-16)29-10-15-7-14(29)11-30-15/h2,4,6,8,12,14-15H,3,5,7,9-11H2,1H3,(H,24,25,26,27)
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46.3n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365283
PNG
(US9868720, No. 350 | [2-Isopropoxy-6-(tetrahydro- ...)
Show SMILES CC(C)Oc1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCOCC1
Show InChI InChI=1S/C18H21F3N4O2/c1-11(2)27-17-23-14(12-4-7-26-8-5-12)10-16(25-17)24-15-9-13(3-6-22-15)18(19,20)21/h3,6,9-12H,4-5,7-8H2,1-2H3,(H,22,23,24,25)
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47.5n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365301
PNG
(4-[2-(2-Methyl-pyrrolidin- 1-yl)-6-(4-trifluoromet...)
Show SMILES CC1CCCN1c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCNC(=O)C1
Show InChI InChI=1/C20H23F3N6O/c1-12-3-2-8-29(12)19-26-15(13-4-6-25-18(30)9-13)11-17(28-19)27-16-10-14(5-7-24-16)20(21,22)23/h5,7,10-13H,2-4,6,8-9H2,1H3,(H,25,30)(H,24,26,27,28)
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47.5n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365224
PNG
(US9868720, No. 25 | {4-[6-(4-Methyl-pyridin- 2-yla...)
Show SMILES Cc1ccnc(Nc2cc(nc(n2)N2CCCC2)C2CCN(CC2)C(=O)c2ccccc2)c1
Show InChI InChI=1S/C26H30N6O/c1-19-9-12-27-23(17-19)29-24-18-22(28-26(30-24)32-13-5-6-14-32)20-10-15-31(16-11-20)25(33)21-7-3-2-4-8-21/h2-4,7-9,12,17-18,20H,5-6,10-11,13-16H2,1H3,(H,27,28,29,30)
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50n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365220
PNG
(Preparation of 1-acetyl-4-(2-(3,3-difluoropyrrolid...)
Show SMILES Cc1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCCN(C1)C(=O)c1ccc(F)cc1Cl
Show InChI InChI=1/C23H20ClF4N5O/c1-13-30-19(11-21(31-13)32-20-9-15(6-7-29-20)23(26,27)28)14-3-2-8-33(12-14)22(34)17-5-4-16(25)10-18(17)24/h4-7,9-11,14H,2-3,8,12H2,1H3,(H,29,30,31,32)
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52.1n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365285
PNG
(1-{4-[2-((R)-2-Methoxy- methyl-pyrrolidin-1-yl)- 6...)
Show SMILES COC[C@H]1CCCN1c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCN(CC1)C(C)=O
Show InChI InChI=1/C23H29F3N6O2/c1-15(33)31-10-6-16(7-11-31)19-13-21(29-20-12-17(5-8-27-20)23(24,25)26)30-22(28-19)32-9-3-4-18(32)14-34-2/h5,8,12-13,16,18H,3-4,6-7,9-11,14H2,1-2H3,(H,27,28,29,30)/t18-/s2
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54.8n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365234
PNG
(1-{3-[6-(4-Methyl-pyridin- 2-ylamino)-2-pyrrolidin...)
Show SMILES CC(=O)N1CCC(C1)c1cc(Nc2cc(C)ccn2)nc(n1)N1CCCC1
Show InChI InChI=1/C20H26N6O/c1-14-5-7-21-18(11-14)23-19-12-17(16-6-10-26(13-16)15(2)27)22-20(24-19)25-8-3-4-9-25/h5,7,11-12,16H,3-4,6,8-10,13H2,1-2H3,(H,21,22,23,24)
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59n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365221
PNG
(US9868720, No. 21 | {3-[6-(4-Ethoxy-pyridin- 2-yla...)
Show SMILES CCOc1ccnc(Nc2cc(nc(C)n2)C2CCCN(C2)C(=O)c2ccccc2)c1
Show InChI InChI=1/C24H27N5O2/c1-3-31-20-11-12-25-22(14-20)28-23-15-21(26-17(2)27-23)19-10-7-13-29(16-19)24(30)18-8-5-4-6-9-18/h4-6,8-9,11-12,14-15,19H,3,7,10,13,16H2,1-2H3,(H,25,26,27,28)
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60.7n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365278
PNG
(US9868720, No. 329 | [6-(1-Methyl-piperidin- 3-yl)...)
Show SMILES CN1CCCC(C1)c1cc(Nc2cc(ccn2)C(F)(F)F)nc(n1)N1CC2CCC(C1)O2
Show InChI InChI=1/C22H27F3N6O/c1-30-8-2-3-14(11-30)18-10-20(28-19-9-15(6-7-26-19)22(23,24)25)29-21(27-18)31-12-16-4-5-17(13-31)32-16/h6-7,9-10,14,16-17H,2-5,8,11-13H2,1H3,(H,26,27,28,29)
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70.1n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365264
PNG
(4-[2-((R)-2-Methyl- pyrrolidin-1-yl)-6-(4- trifluo...)
Show SMILES C[C@@H]1CCCN1c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1(CCOCC1)C#N
Show InChI InChI=1/C21H23F3N6O/c1-14-3-2-8-30(14)19-27-16(20(13-25)5-9-31-10-6-20)12-18(29-19)28-17-11-15(4-7-26-17)21(22,23)24/h4,7,11-12,14H,2-3,5-6,8-10H2,1H3,(H,26,27,28,29)/t14-/s2
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76.8n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365274
PNG
(US9868720, No. 295 | [2-[1,4]Oxazepan-4-yl- 6-(tet...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)N2CCCOCC2)C2CCOCC2)c1
Show InChI InChI=1S/C20H24F3N5O2/c21-20(22,23)15-2-5-24-17(12-15)26-18-13-16(14-3-9-30-10-4-14)25-19(27-18)28-6-1-8-29-11-7-28/h2,5,12-14H,1,3-4,6-11H2,(H,24,25,26,27)
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82.7n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365269
PNG
(US9868720, No. 253 | [2-(5,6-Dihydro-8H- imidazo[1...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)N2CCn3ccnc3C2)C2CCOCC2)c1
Show InChI InChI=1S/C21H22F3N7O/c22-21(23,24)15-1-4-25-17(11-15)28-18-12-16(14-2-9-32-10-3-14)27-20(29-18)31-8-7-30-6-5-26-19(30)13-31/h1,4-6,11-12,14H,2-3,7-10,13H2,(H,25,27,28,29)
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87.7n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365300
PNG
(4-[2-Isopropyl-6-(4-trifluoro- methyl-pyridin-2-yl...)
Show SMILES CC(C)c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCNC(=O)C1
Show InChI InChI=1/C18H20F3N5O/c1-10(2)17-24-13(11-3-5-23-16(27)7-11)9-15(26-17)25-14-8-12(4-6-22-14)18(19,20)21/h4,6,8-11H,3,5,7H2,1-2H3,(H,23,27)(H,22,24,25,26)
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97.8n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365244
PNG
(1-{3-[6-(4-Methoxy- pyridin-2-ylamino)-2-(2- methy...)
Show SMILES COc1ccnc(Nc2cc(nc(n2)N2CCCC2C)C2CCN(C2)C(C)=O)c1
Show InChI InChI=1/C21H28N6O2/c1-14-5-4-9-27(14)21-23-18(16-7-10-26(13-16)15(2)28)12-20(25-21)24-19-11-17(29-3)6-8-22-19/h6,8,11-12,14,16H,4-5,7,9-10,13H2,1-3H3,(H,22,23,24,25)
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100n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365284
PNG
(1-{3-[2-Cyclopropyl-6- (4-trifluoromethyl-pyridin-...)
Show SMILES CC(=O)N1CC(C1)c1cc(Nc2cc(ccn2)C(F)(F)F)nc(n1)C1CC1
Show InChI InChI=1S/C18H18F3N5O/c1-10(27)26-8-12(9-26)14-7-16(25-17(23-14)11-2-3-11)24-15-6-13(4-5-22-15)18(19,20)21/h4-7,11-12H,2-3,8-9H2,1H3,(H,22,23,24,25)
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101n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365273
PNG
(2,2-Difluoro-1{-[2(8- oxa-3-aza-bicyclo[3.2.1]oct-...)
Show SMILES FC(F)C(=O)N1CCC(CC1)c1cc(Nc2cc(ccn2)C(F)(F)F)nc(n1)N1CC2CCC(C1)O2
Show InChI InChI=1/C23H25F5N6O2/c24-20(25)21(35)33-7-4-13(5-8-33)17-10-19(31-18-9-14(3-6-29-18)23(26,27)28)32-22(30-17)34-11-15-1-2-16(12-34)36-15/h3,6,9-10,13,15-16,20H,1-2,4-5,7-8,11-12H2,(H,29,30,31,32)
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104n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365235
PNG
(1-{3-[6-(4-Methyl-pyridin- 2-ylamino)-2-piperidin-...)
Show SMILES CC(=O)N1CCC(C1)c1cc(Nc2cc(C)ccn2)nc(n1)N1CCCCC1
Show InChI InChI=1/C21H28N6O/c1-15-6-8-22-19(12-15)24-20-13-18(17-7-11-27(14-17)16(2)28)23-21(25-20)26-9-4-3-5-10-26/h6,8,12-13,17H,3-5,7,9-11,14H2,1-2H3,(H,22,23,24,25)
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104n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365294
PNG
(4-[2-(Tetrahydro-furan- 3-yl)-6-(4-trifluoromethyl...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)C2CCOC2)C2CCNC(=O)C2)c1
Show InChI InChI=1/C19H20F3N5O2/c20-19(21,22)13-2-5-23-15(8-13)26-16-9-14(11-1-4-24-17(28)7-11)25-18(27-16)12-3-6-29-10-12/h2,5,8-9,11-12H,1,3-4,6-7,10H2,(H,24,28)(H,23,25,26,27)
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120n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365296
PNG
(US9868720, No. 401 | [6-(1-Methanesulfonyl- piperi...)
Show SMILES CS(=O)(=O)N1CCCC(C1)c1cc(Nc2cc(ccn2)C(F)(F)F)nc(n1)C1CCOC1
Show InChI InChI=1/C20H24F3N5O3S/c1-32(29,30)28-7-2-3-13(11-28)16-10-18(27-19(25-16)14-5-8-31-12-14)26-17-9-15(4-6-24-17)20(21,22)23/h4,6,9-10,13-14H,2-3,5,7-8,11-12H2,1H3,(H,24,25,26,27)
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122n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365246
PNG
(US9868720, No. 145 | [2-Isopropyl-6-(1-methyl- pip...)
Show SMILES CC(C)c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCCN(C)C1
Show InChI InChI=1/C19H24F3N5/c1-12(2)18-24-15(13-5-4-8-27(3)11-13)10-17(26-18)25-16-9-14(6-7-23-16)19(20,21)22/h6-7,9-10,12-13H,4-5,8,11H2,1-3H3,(H,23,24,25,26)
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141n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365257
PNG
(2,2-Difluoro-1-{3-[2- isobutyl-6-(4-trifluoromethy...)
Show SMILES CC(C)Cc1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CCCN(C1)C(=O)C(F)F
Show InChI InChI=1/C21H24F5N5O/c1-12(2)8-17-28-15(13-4-3-7-31(11-13)20(32)19(22)23)10-18(30-17)29-16-9-14(5-6-27-16)21(24,25)26/h5-6,9-10,12-13,19H,3-4,7-8,11H2,1-2H3,(H,27,28,29,30)
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143n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365277
PNG
(1-[4-(1-Methyl-pyrrolidin- 3-yl)-6-(4-trifluoromet...)
Show SMILES CN1CCC(C1)c1cc(Nc2cc(ccn2)C(F)(F)F)nc(n1)N1CC(C1)C#N
Show InChI InChI=1/C19H20F3N7/c1-28-5-3-13(11-28)15-7-17(27-18(25-15)29-9-12(8-23)10-29)26-16-6-14(2-4-24-16)19(20,21)22/h2,4,6-7,12-13H,3,5,9-11H2,1H3,(H,24,25,26,27)
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147n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365271
PNG
(US9868720, No. 265 | {3-[2-(3,3-Difluoro- azetidin...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)N2CC(F)(F)C2)C2CCN(C2)C(=O)C2CCCO2)c1
Show InChI InChI=1/C22H23F5N6O2/c23-21(24)11-33(12-21)20-29-15(13-4-6-32(10-13)19(34)16-2-1-7-35-16)9-18(31-20)30-17-8-14(3-5-28-17)22(25,26)27/h3,5,8-9,13,16H,1-2,4,6-7,10-12H2,(H,28,29,30,31)
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159n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365229
PNG
(US9868720, No. 51 | [6-(1-Imidazo[1,2-a]pyridin- 2...)
Show SMILES Cc1ccnc(Nc2cc(nc(C)n2)C2CCCN(Cc3cn4ccccc4n3)C2)c1
Show InChI InChI=1/C24H27N7/c1-17-8-9-25-22(12-17)29-23-13-21(26-18(2)27-23)19-6-5-10-30(14-19)15-20-16-31-11-4-3-7-24(31)28-20/h3-4,7-9,11-13,16,19H,5-6,10,14-15H2,1-2H3,(H,25,26,27,29)
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166n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365287
PNG
(2,2-Difluoro-1-{3-[2-(8- oxa-3-aza-bicyclo[3.2. 1]...)
Show SMILES FC(F)C(=O)N1CCC(C1)c1cc(Nc2cc(ccn2)C(F)(F)F)nc(n1)N1CC2CCC(C1)O2
Show InChI InChI=1/C22H23F5N6O2/c23-19(24)20(34)32-6-4-12(9-32)16-8-18(30-17-7-13(3-5-28-17)22(25,26)27)31-21(29-16)33-10-14-1-2-15(11-33)35-14/h3,5,7-8,12,14-15,19H,1-2,4,6,9-11H2,(H,28,29,30,31)
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173n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365275
PNG
(US9868720, No. 296 | [2-(8-Oxa-3-aza-bicyclo- [3.2...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)N2CC3CCC(C2)O3)C2CCOCC2)c1
Show InChI InChI=1/C21H24F3N5O2/c22-21(23,24)14-3-6-25-18(9-14)27-19-10-17(13-4-7-30-8-5-13)26-20(28-19)29-11-15-1-2-16(12-29)31-15/h3,6,9-10,13,15-16H,1-2,4-5,7-8,11-12H2,(H,25,26,27,28)
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174n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365267
PNG
(US9868720, No. 251 | [2-(3-Oxa-8-aza-bicyclo- [3.2...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)N2C3CCC2COC3)C2CCOCC2)c1
Show InChI InChI=1/C21H24F3N5O2/c22-21(23,24)14-3-6-25-18(9-14)27-19-10-17(13-4-7-30-8-5-13)26-20(28-19)29-15-1-2-16(29)12-31-11-15/h3,6,9-10,13,15-16H,1-2,4-5,7-8,11-12H2,(H,25,26,27,28)
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183n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM50059249
PNG
(CHEMBL3393313 | US9868720, No. 6)
Show SMILES CCc1ccnc(Nc2cc(nc(C)n2)C2CCCN(C2)C(=O)c2ccccc2)c1
Show InChI InChI=1/C24H27N5O/c1-3-18-11-12-25-22(14-18)28-23-15-21(26-17(2)27-23)20-10-7-13-29(16-20)24(30)19-8-5-4-6-9-19/h4-6,8-9,11-12,14-15,20H,3,7,10,13,16H2,1-2H3,(H,25,26,27,28)
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195n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365233
PNG
(1-{3-[2-Azetidin-1-yl-6- (4-methyl-pyridin-2- ylam...)
Show SMILES CC(=O)N1CCCC(C1)c1cc(Nc2cc(C)ccn2)nc(n1)N1CCC1
Show InChI InChI=1/C20H26N6O/c1-14-6-7-21-18(11-14)23-19-12-17(22-20(24-19)25-9-4-10-25)16-5-3-8-26(13-16)15(2)27/h6-7,11-12,16H,3-5,8-10,13H2,1-2H3,(H,21,22,23,24)
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262n/an/an/an/an/an/an/an/a



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US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365295
PNG
(US9868720, No. 399 | [2-Isopropyl-6-(1-oxetan 3-yl...)
Show SMILES CC(C)c1nc(Nc2cc(ccn2)C(F)(F)F)cc(n1)C1CN(C1)C1COC1
Show InChI InChI=1S/C19H22F3N5O/c1-11(2)18-24-15(12-7-27(8-12)14-9-28-10-14)6-17(26-18)25-16-5-13(3-4-23-16)19(20,21)22/h3-6,11-12,14H,7-10H2,1-2H3,(H,23,24,25,26)
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281n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365265
PNG
(US9868720, No. 218 | [2-(2-Oxa-6-aza-spiro- [3.3]h...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)N2CC3(COC3)C2)C2CCOCC2)c1
Show InChI InChI=1S/C20H22F3N5O2/c21-20(22,23)14-1-4-24-16(7-14)26-17-8-15(13-2-5-29-6-3-13)25-18(27-17)28-9-19(10-28)11-30-12-19/h1,4,7-8,13H,2-3,5-6,9-12H2,(H,24,25,26,27)
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288n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365230
PNG
((4-Methyl-pyridin-2-yl)- [2-methyl-6-(1-pyridin- 2...)
Show SMILES Cc1ccnc(Nc2cc(nc(C)n2)C2CCCN(Cc3ccccn3)C2)c1
Show InChI InChI=1/C22H26N6/c1-16-8-10-24-21(12-16)27-22-13-20(25-17(2)26-22)18-6-5-11-28(14-18)15-19-7-3-4-9-23-19/h3-4,7-10,12-13,18H,5-6,11,14-15H2,1-2H3,(H,24,25,26,27)
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293n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365228
PNG
(US9868720, No. 49 | [6-(1-Imidazo[1,2-a]pyridin- 6...)
Show SMILES Cc1ccnc(Nc2cc(nc(C)n2)C2CCCN(Cc3ccc4nccn4c3)C2)c1
Show InChI InChI=1/C24H27N7/c1-17-7-8-25-22(12-17)29-23-13-21(27-18(2)28-23)20-4-3-10-30(16-20)14-19-5-6-24-26-9-11-31(24)15-19/h5-9,11-13,15,20H,3-4,10,14,16H2,1-2H3,(H,25,27,28,29)
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310n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365263
PNG
(4-[2,6-Bis-(4-trifluoro- methyl-pyridin-2- ylamino...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(Nc3cc(ccn3)C(F)(F)F)n2)C2(CCOCC2)C#N)c1
Show InChI InChI=1S/C22H17F6N7O/c23-21(24,25)13-1-5-30-16(9-13)33-18-11-15(20(12-29)3-7-36-8-4-20)32-19(35-18)34-17-10-14(2-6-31-17)22(26,27)28/h1-2,5-6,9-11H,3-4,7-8H2,(H2,30,31,32,33,34,35)
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322n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365270
PNG
(Morpholin-4-yl-{1-[4- (tetrahydro-pyran-4-yl)- 6-(...)
Show SMILES FC(F)(F)c1ccnc(Nc2cc(nc(n2)N2CC(C2)C(=O)N2CCOCC2)C2CCOCC2)c1
Show InChI InChI=1S/C23H27F3N6O3/c24-23(25,26)17-1-4-27-19(11-17)29-20-12-18(15-2-7-34-8-3-15)28-22(30-20)32-13-16(14-32)21(33)31-5-9-35-10-6-31/h1,4,11-12,15-16H,2-3,5-10,13-14H2,(H,27,28,29,30)
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347n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365226
PNG
(US9868720, No. 40 | {6-[1-(2,5-Dimethyl-2H- pyrazo...)
Show SMILES Cc1cc(CN2CCCC(C2)c2cc(Nc3cc(C)ccn3)nc(C)n2)n(C)n1
Show InChI InChI=1/C22H29N7/c1-15-7-8-23-21(10-15)26-22-12-20(24-17(3)25-22)18-6-5-9-29(13-18)14-19-11-16(2)27-28(19)4/h7-8,10-12,18H,5-6,9,13-14H2,1-4H3,(H,23,24,25,26)
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392n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM50059257
PNG
(CHEMBL3393309 | US9868720, No. 5)
Show SMILES Cc1ccc(Nc2cc(nc(C)n2)C2CCCN(C2)C(=O)c2ccccc2)nc1
Show InChI InChI=1/C23H25N5O/c1-16-10-11-21(24-14-16)27-22-13-20(25-17(2)26-22)19-9-6-12-28(15-19)23(29)18-7-4-3-5-8-18/h3-5,7-8,10-11,13-14,19H,6,9,12,15H2,1-2H3,(H,24,25,26,27)
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401n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365286
PNG
(US9868720, No. 371 | [6-(1-Methyl-piperidin- 3-yl)...)
Show SMILES CN1CCCC(C1)c1cc(Nc2cc(ccn2)C(F)(F)F)nc(n1)N1CC(C1)N1CCOCC1
Show InChI InChI=1/C23H30F3N7O/c1-31-6-2-3-16(13-31)19-12-21(29-20-11-17(4-5-27-20)23(24,25)26)30-22(28-19)33-14-18(15-33)32-7-9-34-10-8-32/h4-5,11-12,16,18H,2-3,6-10,13-15H2,1H3,(H,27,28,29,30)
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636n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365214
PNG
(Preparation of tert-butyl 3-(2,6-dichloropyrimidin...)
Show SMILES Cc1ccnc(Nc2cc(nc(C)n2)C2CCCN(C2)C(=O)Cc2ccccc2)c1
Show InChI InChI=1/C24H27N5O/c1-17-10-11-25-22(13-17)28-23-15-21(26-18(2)27-23)20-9-6-12-29(16-20)24(30)14-19-7-4-3-5-8-19/h3-5,7-8,10-11,13,15,20H,6,9,12,14,16H2,1-2H3,(H,25,26,27,28)
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639n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM50059253
PNG
(CHEMBL3393311 | US9868720, No. 3)
Show SMILES Cc1nc(Nc2ccc(cn2)C(F)(F)F)cc(n1)C1CCCN(C1)C(=O)c1ccccc1
Show InChI InChI=1/C23H22F3N5O/c1-15-28-19(12-21(29-15)30-20-10-9-18(13-27-20)23(24,25)26)17-8-5-11-31(14-17)22(32)16-6-3-2-4-7-16/h2-4,6-7,9-10,12-13,17H,5,8,11,14H2,1H3,(H,27,28,29,30)
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Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365219
PNG
(Synthesis of tert-butyl 3-(6-chloro-2-cyclopentylp...)
Show SMILES Cc1nc(Nc2cc(ccn2)C(N)=O)cc(n1)C1CCCN(C1)C(=O)c1ccccc1
Show InChI InChI=1/C23H24N6O2/c1-15-26-19(13-21(27-15)28-20-12-17(22(24)30)9-10-25-20)18-8-5-11-29(14-18)23(31)16-6-3-2-4-7-16/h2-4,6-7,9-10,12-13,18H,5,8,11,14H2,1H3,(H2,24,30)(H,25,26,27,28)
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795n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 12


(Homo sapiens (Human))
BDBM365225
PNG
(US9868720, No. 38 | {6-[1-(1,3-Dimethyl-1H- pyrazo...)
Show SMILES Cc1nn(C)cc1CN1CCCC(C1)c1cc(Nc2cc(C)ccn2)nc(C)n1
Show InChI InChI=1/C22H29N7/c1-15-7-8-23-21(10-15)26-22-11-20(24-17(3)25-22)18-6-5-9-29(13-18)14-19-12-28(4)27-16(19)2/h7-8,10-12,18H,5-6,9,13-14H2,1-4H3,(H,23,24,25,26)
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>2.10E+3n/an/an/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...


US Patent US9868720 (2018)

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