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Patent code US9296757

Compile Data Set for Download or QSAR
Found 92 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
GST-MKNK1


(Homo sapiens (Human))
BDBM218770
PNG
(US9296757, 92)
Show SMILES COc1cc2[nH]c(=O)sc2cc1Nc1ncnc2sc3CC(CCc3c12)C(=O)N(CCN(C)C)Cc1ccccc1
Show InChI InChI=1S/C30H32N6O3S2/c1-35(2)11-12-36(16-18-7-5-4-6-8-18)29(37)19-9-10-20-24(13-19)40-28-26(20)27(31-17-32-28)33-21-15-25-22(14-23(21)39-3)34-30(38)41-25/h4-8,14-15,17,19H,9-13,16H2,1-3H3,(H,34,38)(H,31,32,33)
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US Patent
n/an/a 0.600n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218771
PNG
(US9296757, 93)
Show SMILES COCCN(CCOC)C(=O)C1CCc2c(C1)sc1ncnc(Nc3cc4sc(=O)[nH]c4cc3OC)c21
Show InChI InChI=1S/C25H29N5O5S2/c1-33-8-6-30(7-9-34-2)24(31)14-4-5-15-19(10-14)36-23-21(15)22(26-13-27-23)28-16-12-20-17(11-18(16)35-3)29-25(32)37-20/h11-14H,4-10H2,1-3H3,(H,29,32)(H,26,27,28)
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US Patent
n/an/a 0.700n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218766
PNG
(US9296757, 88)
Show SMILES CCCCN(CC#N)C(=O)C1CCc2c(C1)sc1ncnc(Nc3cc4sc(=O)[nH]c4cc3OC)c21
Show InChI InChI=1S/C25H26N6O3S2/c1-3-4-8-31(9-7-26)24(32)14-5-6-15-19(10-14)35-23-21(15)22(27-13-28-23)29-16-12-20-17(11-18(16)34-2)30-25(33)36-20/h11-14H,3-6,8-10H2,1-2H3,(H,30,33)(H,27,28,29)
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n/an/a 1n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218768
PNG
(US9296757, 90)
Show SMILES CCN(CCOC)C(=O)C1CCc2c(C1)sc1ncnc(Nc3cc4sc(=O)[nH]c4cc3OC)c21
Show InChI InChI=1S/C24H27N5O4S2/c1-4-29(7-8-32-2)23(30)13-5-6-14-18(9-13)34-22-20(14)21(25-12-26-22)27-15-11-19-16(10-17(15)33-3)28-24(31)35-19/h10-13H,4-9H2,1-3H3,(H,28,31)(H,25,26,27)
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n/an/a 1n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218767
PNG
(US9296757, 89)
Show SMILES CCCCN(C)C(=O)C1CCc2c(C1)sc1ncnc(Nc3cc4sc(=O)[nH]c4cc3OC)c21
Show InChI InChI=1S/C24H27N5O3S2/c1-4-5-8-29(2)23(30)13-6-7-14-18(9-13)33-22-20(14)21(25-12-26-22)27-15-11-19-16(10-17(15)32-3)28-24(31)34-19/h10-13H,4-9H2,1-3H3,(H,28,31)(H,25,26,27)
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n/an/a 1.90n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218765
PNG
(US9296757, 87)
Show SMILES CCCN(CCOC)C(=O)C1CCc2c(C1)sc1ncnc(Nc3cc4sc(=O)[nH]c4cc3OC)c21
Show InChI InChI=1S/C25H29N5O4S2/c1-4-7-30(8-9-33-2)24(31)14-5-6-15-19(10-14)35-23-21(15)22(26-13-27-23)28-16-12-20-17(11-18(16)34-3)29-25(32)36-20/h11-14H,4-10H2,1-3H3,(H,29,32)(H,26,27,28)
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n/an/a 2n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218764
PNG
(US9296757, 86)
Show SMILES CCN(C(C)C)C(=O)C1CCc2c(C1)sc1ncnc(Nc3cc4sc(=O)[nH]c4cc3OC)c21
Show InChI InChI=1S/C24H27N5O3S2/c1-5-29(12(2)3)23(30)13-6-7-14-18(8-13)33-22-20(14)21(25-11-26-22)27-15-10-19-16(9-17(15)32-4)28-24(31)34-19/h9-13H,5-8H2,1-4H3,(H,28,31)(H,25,26,27)
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n/an/a 3n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218709
PNG
(US9296757, 31)
Show SMILES COc1cc2[nH]c(=O)sc2cc1Nc1ncnc2sc3CC(CCc3c12)C(=O)NC(C)C
Show InChI InChI=1S/C22H23N5O3S2/c1-10(2)25-20(28)11-4-5-12-16(6-11)31-21-18(12)19(23-9-24-21)26-13-8-17-14(7-15(13)30-3)27-22(29)32-17/h7-11H,4-6H2,1-3H3,(H,25,28)(H,27,29)(H,23,24,26)
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n/an/a 4n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218763
PNG
(US9296757, 85)
Show SMILES COc1cc2[nH]c(=O)sc2cc1Nc1ncnc2sc3CC(CCc3c12)C(=O)N(C)C
Show InChI InChI=1S/C21H21N5O3S2/c1-26(2)20(27)10-4-5-11-15(6-10)30-19-17(11)18(22-9-23-19)24-12-8-16-13(7-14(12)29-3)25-21(28)31-16/h7-10H,4-6H2,1-3H3,(H,25,28)(H,22,23,24)
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n/an/a 4n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218687
PNG
(US9296757, 9)
Show SMILES O=C(NCc1ccccc1)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C25H21N5O2S2/c31-23(26-12-14-4-2-1-3-5-14)15-6-8-17-19(10-15)33-24-21(17)22(27-13-28-24)29-16-7-9-18-20(11-16)34-25(32)30-18/h1-5,7,9,11,13,15H,6,8,10,12H2,(H,26,31)(H,30,32)(H,27,28,29)
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n/an/a 9n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218714
PNG
(US9296757, 36)
Show SMILES CN(C)CCN(Cc1ccccc1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C29H30N6O2S2/c1-34(2)12-13-35(16-18-6-4-3-5-7-18)28(36)19-8-10-21-23(14-19)38-27-25(21)26(30-17-31-27)32-20-9-11-22-24(15-20)39-29(37)33-22/h3-7,9,11,15,17,19H,8,10,12-14,16H2,1-2H3,(H,33,37)(H,30,31,32)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218688
PNG
(US9296757, 10)
Show SMILES FC(F)(F)c1cccc(CNC(=O)C2CCc3c(C2)sc2ncnc(Nc4ccc5[nH]c(=O)sc5c4)c32)c1
Show InChI InChI=1S/C26H20F3N5O2S2/c27-26(28,29)15-3-1-2-13(8-15)11-30-23(35)14-4-6-17-19(9-14)37-24-21(17)22(31-12-32-24)33-16-5-7-18-20(10-16)38-25(36)34-18/h1-3,5,7-8,10,12,14H,4,6,9,11H2,(H,30,35)(H,34,36)(H,31,32,33)
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n/an/a 11n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218708
PNG
(US9296757, 30 | US9296757, 33)
Show SMILES CCOC(=O)C1CCc2c(C1)sc1ncnc(Nc3cc4sc(=O)[nH]c4cc3OC)c21
Show InChI InChI=1S/C21H20N4O4S2/c1-3-29-20(26)10-4-5-11-15(6-10)30-19-17(11)18(22-9-23-19)24-12-8-16-13(7-14(12)28-2)25-21(27)31-16/h7-10H,3-6H2,1-2H3,(H,25,27)(H,22,23,24)
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n/an/a 15n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218747
PNG
(US9296757, 69)
Show SMILES CCCN(CCOC)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C24H27N5O3S2/c1-3-8-29(9-10-32-2)23(30)14-4-6-16-18(11-14)33-22-20(16)21(25-13-26-22)27-15-5-7-17-19(12-15)34-24(31)28-17/h5,7,12-14H,3-4,6,8-11H2,1-2H3,(H,28,31)(H,25,26,27)
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n/an/a 19n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218712
PNG
(US9296757, 34)
Show SMILES CCCCN(CC#N)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C24H24N6O2S2/c1-2-3-9-30(10-8-25)23(31)14-4-6-16-18(11-14)33-22-20(16)21(26-13-27-22)28-15-5-7-17-19(12-15)34-24(32)29-17/h5,7,12-14H,2-4,6,9-11H2,1H3,(H,29,32)(H,26,27,28)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218719
PNG
(US9296757, 41)
Show SMILES CCCCN(C)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C23H25N5O2S2/c1-3-4-9-28(2)22(29)13-5-7-15-17(10-13)31-21-19(15)20(24-12-25-21)26-14-6-8-16-18(11-14)32-23(30)27-16/h6,8,11-13H,3-5,7,9-10H2,1-2H3,(H,27,30)(H,24,25,26)
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n/an/a 21n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218707
PNG
(US9296757, 29 | US9296757, 37)
Show SMILES CN1CCN(CC1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C23H24N6O2S2/c1-28-6-8-29(9-7-28)22(30)13-2-4-15-17(10-13)32-21-19(15)20(24-12-25-21)26-14-3-5-16-18(11-14)33-23(31)27-16/h3,5,11-13H,2,4,6-10H2,1H3,(H,27,31)(H,24,25,26)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218748
PNG
(US9296757, 70)
Show SMILES CCN(CCOC)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C23H25N5O3S2/c1-3-28(8-9-31-2)22(29)13-4-6-15-17(10-13)32-21-19(15)20(24-12-25-21)26-14-5-7-16-18(11-14)33-23(30)27-16/h5,7,11-13H,3-4,6,8-10H2,1-2H3,(H,27,30)(H,24,25,26)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218692
PNG
(US9296757, 14)
Show SMILES Fc1cccc(CNC(=O)C2CCc3c(C2)sc2ncnc(Nc4ccc5[nH]c(=O)sc5c4)c32)c1
Show InChI InChI=1S/C25H20FN5O2S2/c26-15-3-1-2-13(8-15)11-27-23(32)14-4-6-17-19(9-14)34-24-21(17)22(28-12-29-24)30-16-5-7-18-20(10-16)35-25(33)31-18/h1-3,5,7-8,10,12,14H,4,6,9,11H2,(H,27,32)(H,31,33)(H,28,29,30)
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n/an/a 25n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218742
PNG
(US9296757, 64)
Show SMILES O=C(C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21)N1CCN2CCCCC2C1
Show InChI InChI=1S/C26H28N6O2S2/c33-25(32-10-9-31-8-2-1-3-17(31)13-32)15-4-6-18-20(11-15)35-24-22(18)23(27-14-28-24)29-16-5-7-19-21(12-16)36-26(34)30-19/h5,7,12,14-15,17H,1-4,6,8-11,13H2,(H,30,34)(H,27,28,29)
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n/an/a 27n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218734
PNG
(US9296757, 56)
Show SMILES CN(CC1CCCO1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C24H25N5O3S2/c1-29(11-15-3-2-8-32-15)23(30)13-4-6-16-18(9-13)33-22-20(16)21(25-12-26-22)27-14-5-7-17-19(10-14)34-24(31)28-17/h5,7,10,12-13,15H,2-4,6,8-9,11H2,1H3,(H,28,31)(H,25,26,27)
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n/an/a 27n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218732
PNG
(US9296757, 54)
Show SMILES CC(C)N(CCO)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C23H25N5O3S2/c1-12(2)28(7-8-29)22(30)13-3-5-15-17(9-13)32-21-19(15)20(24-11-25-21)26-14-4-6-16-18(10-14)33-23(31)27-16/h4,6,10-13,29H,3,5,7-9H2,1-2H3,(H,27,31)(H,24,25,26)
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n/an/a 28n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218730
PNG
(US9296757, 52)
Show SMILES COCCN(CCOC)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C24H27N5O4S2/c1-32-9-7-29(8-10-33-2)23(30)14-3-5-16-18(11-14)34-22-20(16)21(25-13-26-22)27-15-4-6-17-19(12-15)35-24(31)28-17/h4,6,12-14H,3,5,7-11H2,1-2H3,(H,28,31)(H,25,26,27)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218762
PNG
(US9296757, 84)
Show SMILES COC1CCCN(C1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C24H25N5O3S2/c1-32-15-3-2-8-29(11-15)23(30)13-4-6-16-18(9-13)33-22-20(16)21(25-12-26-22)27-14-5-7-17-19(10-14)34-24(31)28-17/h5,7,10,12-13,15H,2-4,6,8-9,11H2,1H3,(H,28,31)(H,25,26,27)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218753
PNG
(US9296757, 75)
Show SMILES O=C(C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21)N1CCCC(C1)C#N
Show InChI InChI=1S/C24H22N6O2S2/c25-10-13-2-1-7-30(11-13)23(31)14-3-5-16-18(8-14)33-22-20(16)21(26-12-27-22)28-15-4-6-17-19(9-15)34-24(32)29-17/h4,6,9,12-14H,1-3,5,7-8,11H2,(H,29,32)(H,26,27,28)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218739
PNG
(US9296757, 61)
Show SMILES CN(C1CCN(C1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21)C(C)=O
Show InChI InChI=1S/C25H26N6O3S2/c1-13(32)30(2)16-7-8-31(11-16)24(33)14-3-5-17-19(9-14)35-23-21(17)22(26-12-27-23)28-15-4-6-18-20(10-15)36-25(34)29-18/h4,6,10,12,14,16H,3,5,7-9,11H2,1-2H3,(H,29,34)(H,26,27,28)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218746
PNG
(US9296757, 68)
Show SMILES CC1CN(CC(C)O1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C24H25N5O3S2/c1-12-9-29(10-13(2)32-12)23(30)14-3-5-16-18(7-14)33-22-20(16)21(25-11-26-22)27-15-4-6-17-19(8-15)34-24(31)28-17/h4,6,8,11-14H,3,5,7,9-10H2,1-2H3,(H,28,31)(H,25,26,27)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218686
PNG
(US9296757, 8)
Show SMILES O=C(Nc1ccccc1)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C24H19N5O2S2/c30-22(28-14-4-2-1-3-5-14)13-6-8-16-18(10-13)32-23-20(16)21(25-12-26-23)27-15-7-9-17-19(11-15)33-24(31)29-17/h1-5,7,9,11-13H,6,8,10H2,(H,28,30)(H,29,31)(H,25,26,27)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218744
PNG
(US9296757, 66)
Show SMILES CN(CCCCO)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C23H25N5O3S2/c1-28(8-2-3-9-29)22(30)13-4-6-15-17(10-13)32-21-19(15)20(24-12-25-21)26-14-5-7-16-18(11-14)33-23(31)27-16/h5,7,11-13,29H,2-4,6,8-10H2,1H3,(H,27,31)(H,24,25,26)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218751
PNG
(US9296757, 73)
Show SMILES CN(C)C1CCN(C1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C24H26N6O2S2/c1-29(2)15-7-8-30(11-15)23(31)13-3-5-16-18(9-13)33-22-20(16)21(25-12-26-22)27-14-4-6-17-19(10-14)34-24(32)28-17/h4,6,10,12-13,15H,3,5,7-9,11H2,1-2H3,(H,28,32)(H,25,26,27)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218756
PNG
(US9296757, 78)
Show SMILES O=C(C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21)N1CCN(CC2CC2)CC1
Show InChI InChI=1S/C26H28N6O2S2/c33-25(32-9-7-31(8-10-32)13-15-1-2-15)16-3-5-18-20(11-16)35-24-22(18)23(27-14-28-24)29-17-4-6-19-21(12-17)36-26(34)30-19/h4,6,12,14-16H,1-3,5,7-11,13H2,(H,30,34)(H,27,28,29)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218759
PNG
(US9296757, 81)
Show SMILES CN1CCN(CC1CCO)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C25H28N6O3S2/c1-30-7-8-31(12-16(30)6-9-32)24(33)14-2-4-17-19(10-14)35-23-21(17)22(26-13-27-23)28-15-3-5-18-20(11-15)36-25(34)29-18/h3,5,11,13-14,16,32H,2,4,6-10,12H2,1H3,(H,29,34)(H,26,27,28)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218724
PNG
(US9296757, 46)
Show SMILES OCC1CCCN1C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C23H23N5O3S2/c29-10-14-2-1-7-28(14)22(30)12-3-5-15-17(8-12)32-21-19(15)20(24-11-25-21)26-13-4-6-16-18(9-13)33-23(31)27-16/h4,6,9,11-12,14,29H,1-3,5,7-8,10H2,(H,27,31)(H,24,25,26)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218713
PNG
(US9296757, 35)
Show SMILES CN(C)CCN(C)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C23H26N6O2S2/c1-28(2)8-9-29(3)22(30)13-4-6-15-17(10-13)32-21-19(15)20(24-12-25-21)26-14-5-7-16-18(11-14)33-23(31)27-16/h5,7,11-13H,4,6,8-10H2,1-3H3,(H,27,31)(H,24,25,26)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218683
PNG
(US9296757, 5)
Show SMILES CC(C)NC(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C21H21N5O2S2/c1-10(2)24-19(27)11-3-5-13-15(7-11)29-20-17(13)18(22-9-23-20)25-12-4-6-14-16(8-12)30-21(28)26-14/h4,6,8-11H,3,5,7H2,1-2H3,(H,24,27)(H,26,28)(H,22,23,25)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218738
PNG
(US9296757, 60)
Show SMILES CCN1CCN(CC1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C24H26N6O2S2/c1-2-29-7-9-30(10-8-29)23(31)14-3-5-16-18(11-14)33-22-20(16)21(25-13-26-22)27-15-4-6-17-19(12-15)34-24(32)28-17/h4,6,12-14H,2-3,5,7-11H2,1H3,(H,28,32)(H,25,26,27)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218699
PNG
(US9296757, 21)
Show SMILES CC(C)C(=O)NCC1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C22H23N5O2S2/c1-11(2)20(28)23-9-12-3-5-14-16(7-12)30-21-18(14)19(24-10-25-21)26-13-4-6-15-17(8-13)31-22(29)27-15/h4,6,8,10-12H,3,5,7,9H2,1-2H3,(H,23,28)(H,27,29)(H,24,25,26)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218741
PNG
(US9296757, 63)
Show SMILES CCN(CCC#N)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C23H22N6O2S2/c1-2-29(9-3-8-24)22(30)13-4-6-15-17(10-13)32-21-19(15)20(25-12-26-21)27-14-5-7-16-18(11-14)33-23(31)28-16/h5,7,11-13H,2-4,6,9-10H2,1H3,(H,28,31)(H,25,26,27)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218757
PNG
(US9296757, 79)
Show SMILES O=C(C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21)N1CC(C1)N1CCCCC1
Show InChI InChI=1S/C26H28N6O2S2/c33-25(32-12-17(13-32)31-8-2-1-3-9-31)15-4-6-18-20(10-15)35-24-22(18)23(27-14-28-24)29-16-5-7-19-21(11-16)36-26(34)30-19/h5,7,11,14-15,17H,1-4,6,8-10,12-13H2,(H,30,34)(H,27,28,29)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218769
PNG
(US9296757, 91)
Show SMILES O=C(C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21)N1CC(C1)C#N
Show InChI InChI=1S/C22H18N6O2S2/c23-7-11-8-28(9-11)21(29)12-1-3-14-16(5-12)31-20-18(14)19(24-10-25-20)26-13-2-4-15-17(6-13)32-22(30)27-15/h2,4,6,10-12H,1,3,5,8-9H2,(H,27,30)(H,24,25,26)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218681
PNG
(US9296757, 3)
Show SMILES CCNC(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C20H19N5O2S2/c1-2-21-18(26)10-3-5-12-14(7-10)28-19-16(12)17(22-9-23-19)24-11-4-6-13-15(8-11)29-20(27)25-13/h4,6,8-10H,2-3,5,7H2,1H3,(H,21,26)(H,25,27)(H,22,23,24)
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n/an/a 39n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218735
PNG
(US9296757, 57)
Show SMILES OCCCN1CCN(CC1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C25H28N6O3S2/c32-11-1-6-30-7-9-31(10-8-30)24(33)15-2-4-17-19(12-15)35-23-21(17)22(26-14-27-23)28-16-3-5-18-20(13-16)36-25(34)29-18/h3,5,13-15,32H,1-2,4,6-12H2,(H,29,34)(H,26,27,28)
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n/an/a 39n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218684
PNG
(US9296757, 6)
Show SMILES CC(C)CNC(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C22H23N5O2S2/c1-11(2)9-23-20(28)12-3-5-14-16(7-12)30-21-18(14)19(24-10-25-21)26-13-4-6-15-17(8-13)31-22(29)27-15/h4,6,8,10-12H,3,5,7,9H2,1-2H3,(H,23,28)(H,27,29)(H,24,25,26)
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n/an/a 40n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218740
PNG
(US9296757, 62)
Show SMILES CN(C)C(=O)CN(C)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C23H24N6O3S2/c1-28(2)18(30)10-29(3)22(31)12-4-6-14-16(8-12)33-21-19(14)20(24-11-25-21)26-13-5-7-15-17(9-13)34-23(32)27-15/h5,7,9,11-12H,4,6,8,10H2,1-3H3,(H,27,32)(H,24,25,26)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218737
PNG
(US9296757, 59)
Show SMILES CCN(C)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C21H21N5O2S2/c1-3-26(2)20(27)11-4-6-13-15(8-11)29-19-17(13)18(22-10-23-19)24-12-5-7-14-16(9-12)30-21(28)25-14/h5,7,9-11H,3-4,6,8H2,1-2H3,(H,25,28)(H,22,23,24)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218691
PNG
(US9296757, 13)
Show SMILES CN(C)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C20H19N5O2S2/c1-25(2)19(26)10-3-5-12-14(7-10)28-18-16(12)17(21-9-22-18)23-11-4-6-13-15(8-11)29-20(27)24-13/h4,6,8-10H,3,5,7H2,1-2H3,(H,24,27)(H,21,22,23)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218755
PNG
(US9296757, 77)
Show SMILES COCC1CCCN1C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C24H25N5O3S2/c1-32-11-15-3-2-8-29(15)23(30)13-4-6-16-18(9-13)33-22-20(16)21(25-12-26-22)27-14-5-7-17-19(10-14)34-24(31)28-17/h5,7,10,12-13,15H,2-4,6,8-9,11H2,1H3,(H,28,31)(H,25,26,27)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218708
PNG
(US9296757, 30 | US9296757, 33)
Show SMILES CCOC(=O)C1CCc2c(C1)sc1ncnc(Nc3cc4sc(=O)[nH]c4cc3OC)c21
Show InChI InChI=1S/C21H20N4O4S2/c1-3-29-20(26)10-4-5-11-15(6-10)30-19-17(11)18(22-9-23-19)24-12-8-16-13(7-14(12)28-2)25-21(27)31-16/h7-10H,3-6H2,1-2H3,(H,25,27)(H,22,23,24)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218703
PNG
(US9296757, 25)
Show SMILES CC(C)(O)C(=O)NCC1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C22H23N5O3S2/c1-22(2,30)20(28)23-9-11-3-5-13-15(7-11)31-19-17(13)18(24-10-25-19)26-12-4-6-14-16(8-12)32-21(29)27-14/h4,6,8,10-11,30H,3,5,7,9H2,1-2H3,(H,23,28)(H,27,29)(H,24,25,26)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218758
PNG
(US9296757, 80)
Show SMILES CN(C1CCOC(C)(C)C1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C26H29N5O3S2/c1-26(2)12-16(8-9-34-26)31(3)24(32)14-4-6-17-19(10-14)35-23-21(17)22(27-13-28-23)29-15-5-7-18-20(11-15)36-25(33)30-18/h5,7,11,13-14,16H,4,6,8-10,12H2,1-3H3,(H,30,33)(H,27,28,29)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218685
PNG
(US9296757, 7)
Show SMILES FC(F)(F)CCNC(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C21H18F3N5O2S2/c22-21(23,24)5-6-25-18(30)10-1-3-12-14(7-10)32-19-16(12)17(26-9-27-19)28-11-2-4-13-15(8-11)33-20(31)29-13/h2,4,8-10H,1,3,5-7H2,(H,25,30)(H,29,31)(H,26,27,28)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218701
PNG
(US9296757, 23)
Show SMILES O[C@@H](Cc1ccccc1)C(=O)NCC1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C27H25N5O3S2/c33-20(10-15-4-2-1-3-5-15)25(34)28-13-16-6-8-18-21(11-16)36-26-23(18)24(29-14-30-26)31-17-7-9-19-22(12-17)37-27(35)32-19/h1-5,7,9,12,14,16,20,33H,6,8,10-11,13H2,(H,28,34)(H,32,35)(H,29,30,31)/t16?,20-/m0/s1
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218728
PNG
(US9296757, 50)
Show SMILES CC1CCN(CC1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C24H25N5O2S2/c1-13-6-8-29(9-7-13)23(30)14-2-4-16-18(10-14)32-22-20(16)21(25-12-26-22)27-15-3-5-17-19(11-15)33-24(31)28-17/h3,5,11-14H,2,4,6-10H2,1H3,(H,28,31)(H,25,26,27)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218750
PNG
(US9296757, 72)
Show SMILES COCCN1CCN(CC1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C25H28N6O3S2/c1-34-11-10-30-6-8-31(9-7-30)24(32)15-2-4-17-19(12-15)35-23-21(17)22(26-14-27-23)28-16-3-5-18-20(13-16)36-25(33)29-18/h3,5,13-15H,2,4,6-12H2,1H3,(H,29,33)(H,26,27,28)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218716
PNG
(US9296757, 38)
Show SMILES O=C(C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21)N1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C29H28N6O2S2/c36-28(35-12-10-34(11-13-35)16-18-4-2-1-3-5-18)19-6-8-21-23(14-19)38-27-25(21)26(30-17-31-27)32-20-7-9-22-24(15-20)39-29(37)33-22/h1-5,7,9,15,17,19H,6,8,10-14,16H2,(H,33,37)(H,30,31,32)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218727
PNG
(US9296757, 49)
Show SMILES CN(CC#N)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C21H18N6O2S2/c1-27(7-6-22)20(28)11-2-4-13-15(8-11)30-19-17(13)18(23-10-24-19)25-12-3-5-14-16(9-12)31-21(29)26-14/h3,5,9-11H,2,4,7-8H2,1H3,(H,26,29)(H,23,24,25)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218760
PNG
(US9296757, 82)
Show SMILES CN(CCN1CCOCC1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C25H28N6O3S2/c1-30(6-7-31-8-10-34-11-9-31)24(32)15-2-4-17-19(12-15)35-23-21(17)22(26-14-27-23)28-16-3-5-18-20(13-16)36-25(33)29-18/h3,5,13-15H,2,4,6-12H2,1H3,(H,29,33)(H,26,27,28)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218720
PNG
(US9296757, 42)
Show SMILES COc1ccc(cc1)N(C)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C26H23N5O3S2/c1-31(16-5-7-17(34-2)8-6-16)25(32)14-3-9-18-20(11-14)35-24-22(18)23(27-13-28-24)29-15-4-10-19-21(12-15)36-26(33)30-19/h4-8,10,12-14H,3,9,11H2,1-2H3,(H,30,33)(H,27,28,29)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218749
PNG
(US9296757, 71)
Show SMILES OCC1CCN(CC1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C24H25N5O3S2/c30-11-13-5-7-29(8-6-13)23(31)14-1-3-16-18(9-14)33-22-20(16)21(25-12-26-22)27-15-2-4-17-19(10-15)34-24(32)28-17/h2,4,10,12-14,30H,1,3,5-9,11H2,(H,28,32)(H,25,26,27)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218725
PNG
(US9296757, 47)
Show SMILES CC(=O)N1CCN(CC1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C24H24N6O3S2/c1-13(31)29-6-8-30(9-7-29)23(32)14-2-4-16-18(10-14)34-22-20(16)21(25-12-26-22)27-15-3-5-17-19(11-15)35-24(33)28-17/h3,5,11-12,14H,2,4,6-10H2,1H3,(H,28,33)(H,25,26,27)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218752
PNG
(US9296757, 74)
Show SMILES CN1CC2CC1CN2C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C24H24N6O2S2/c1-29-9-15-8-14(29)10-30(15)23(31)12-2-4-16-18(6-12)33-22-20(16)21(25-11-26-22)27-13-3-5-17-19(7-13)34-24(32)28-17/h3,5,7,11-12,14-15H,2,4,6,8-10H2,1H3,(H,28,32)(H,25,26,27)
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n/an/a 47n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218679
PNG
(US9296757, 1)
Show SMILES CCOC(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C20H18N4O3S2/c1-2-27-19(25)10-3-5-12-14(7-10)28-18-16(12)17(21-9-22-18)23-11-4-6-13-15(8-11)29-20(26)24-13/h4,6,8-10H,2-3,5,7H2,1H3,(H,24,26)(H,21,22,23)
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n/an/a 47n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218690
PNG
(US9296757, 12)
Show SMILES O=C(NCC1CC1)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C22H21N5O2S2/c28-20(23-9-11-1-2-11)12-3-5-14-16(7-12)30-21-18(14)19(24-10-25-21)26-13-4-6-15-17(8-13)31-22(29)27-15/h4,6,8,10-12H,1-3,5,7,9H2,(H,23,28)(H,27,29)(H,24,25,26)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218707
PNG
(US9296757, 29 | US9296757, 37)
Show SMILES CN1CCN(CC1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C23H24N6O2S2/c1-28-6-8-29(9-7-28)22(30)13-2-4-15-17(10-13)32-21-19(15)20(24-12-25-21)26-14-3-5-16-18(11-14)33-23(31)27-16/h3,5,11-13H,2,4,6-10H2,1H3,(H,27,31)(H,24,25,26)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218761
PNG
(US9296757, 83)
Show SMILES O=C(C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21)N1CC2(COC2)C1
Show InChI InChI=1S/C23H21N5O3S2/c29-21(28-7-23(8-28)9-31-10-23)12-1-3-14-16(5-12)32-20-18(14)19(24-11-25-20)26-13-2-4-15-17(6-13)33-22(30)27-15/h2,4,6,11-12H,1,3,5,7-10H2,(H,27,30)(H,24,25,26)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218731
PNG
(US9296757, 53)
Show SMILES OC1CCCN(C1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C23H23N5O3S2/c29-14-2-1-7-28(10-14)22(30)12-3-5-15-17(8-12)32-21-19(15)20(24-11-25-21)26-13-4-6-16-18(9-13)33-23(31)27-16/h4,6,9,11-12,14,29H,1-3,5,7-8,10H2,(H,27,31)(H,24,25,26)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218754
PNG
(US9296757, 76)
Show SMILES O=C(C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21)N1CCC(CC1)C#N
Show InChI InChI=1S/C24H22N6O2S2/c25-11-13-5-7-30(8-6-13)23(31)14-1-3-16-18(9-14)33-22-20(16)21(26-12-27-22)28-15-2-4-17-19(10-15)34-24(32)29-17/h2,4,10,12-14H,1,3,5-9H2,(H,29,32)(H,26,27,28)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218682
PNG
(US9296757, 4)
Show SMILES O=C(NC1CC1)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C21H19N5O2S2/c27-19(25-11-2-3-11)10-1-5-13-15(7-10)29-20-17(13)18(22-9-23-20)24-12-4-6-14-16(8-12)30-21(28)26-14/h4,6,8-11H,1-3,5,7H2,(H,25,27)(H,26,28)(H,22,23,24)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218700
PNG
(US9296757, 22)
Show SMILES CC(C)NC(=O)NCC1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C22H24N6O2S2/c1-11(2)26-21(29)23-9-12-3-5-14-16(7-12)31-20-18(14)19(24-10-25-20)27-13-4-6-15-17(8-13)32-22(30)28-15/h4,6,8,10-12H,3,5,7,9H2,1-2H3,(H,28,30)(H2,23,26,29)(H,24,25,27)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218680
PNG
(US9296757, 18 | US9296757, 2)
Show SMILES OC(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C18H14N4O3S2/c23-17(24)8-1-3-10-12(5-8)26-16-14(10)15(19-7-20-16)21-9-2-4-11-13(6-9)27-18(25)22-11/h2,4,6-8H,1,3,5H2,(H,22,25)(H,23,24)(H,19,20,21)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218702
PNG
(US9296757, 24)
Show SMILES CC(C)OC(=O)NCC1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C22H23N5O3S2/c1-11(2)30-21(28)23-9-12-3-5-14-16(7-12)31-20-18(14)19(24-10-25-20)26-13-4-6-15-17(8-13)32-22(29)27-15/h4,6,8,10-12H,3,5,7,9H2,1-2H3,(H,23,28)(H,27,29)(H,24,25,26)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218745
PNG
(US9296757, 67)
Show SMILES CN(CCCO)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C22H23N5O3S2/c1-27(7-2-8-28)21(29)12-3-5-14-16(9-12)31-20-18(14)19(23-11-24-20)25-13-4-6-15-17(10-13)32-22(30)26-15/h4,6,10-12,28H,2-3,5,7-9H2,1H3,(H,26,30)(H,23,24,25)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218736
PNG
(US9296757, 58)
Show SMILES CC(C)CN(C)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C23H25N5O2S2/c1-12(2)10-28(3)22(29)13-4-6-15-17(8-13)31-21-19(15)20(24-11-25-21)26-14-5-7-16-18(9-14)32-23(30)27-16/h5,7,9,11-13H,4,6,8,10H2,1-3H3,(H,27,30)(H,24,25,26)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218726
PNG
(US9296757, 48)
Show SMILES CN(CC[N+]#[C-])C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C22H20N6O2S2/c1-23-7-8-28(2)21(29)12-3-5-14-16(9-12)31-20-18(14)19(24-11-25-20)26-13-4-6-15-17(10-13)32-22(30)27-15/h4,6,10-12H,3,5,7-9H2,2H3,(H,27,30)(H,24,25,26)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218718
PNG
(US9296757, 40)
Show SMILES O=C(C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21)N1CCN(CC1)c1ccccn1
Show InChI InChI=1S/C27H25N7O2S2/c35-26(34-11-9-33(10-12-34)22-3-1-2-8-28-22)16-4-6-18-20(13-16)37-25-23(18)24(29-15-30-25)31-17-5-7-19-21(14-17)38-27(36)32-19/h1-3,5,7-8,14-16H,4,6,9-13H2,(H,32,36)(H,29,30,31)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218722
PNG
(US9296757, 44)
Show SMILES O=C(C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21)N1CCN(Cc2ccc3OCOc3c2)CC1
Show InChI InChI=1S/C30H28N6O4S2/c37-29(36-9-7-35(8-10-36)14-17-1-6-22-23(11-17)40-16-39-22)18-2-4-20-24(12-18)41-28-26(20)27(31-15-32-28)33-19-3-5-21-25(13-19)42-30(38)34-21/h1,3,5-6,11,13,15,18H,2,4,7-10,12,14,16H2,(H,34,38)(H,31,32,33)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218721
PNG
(US9296757, 43)
Show SMILES O=C(CN1CCN(CC1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21)N1CCCC1
Show InChI InChI=1S/C28H31N7O3S2/c36-23(34-7-1-2-8-34)15-33-9-11-35(12-10-33)27(37)17-3-5-19-21(13-17)39-26-24(19)25(29-16-30-26)31-18-4-6-20-22(14-18)40-28(38)32-20/h4,6,14,16-17H,1-3,5,7-13,15H2,(H,32,38)(H,29,30,31)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218723
PNG
(US9296757, 45)
Show SMILES O=C(C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21)N1CCC1
Show InChI InChI=1S/C21H19N5O2S2/c27-20(26-6-1-7-26)11-2-4-13-15(8-11)29-19-17(13)18(22-10-23-19)24-12-3-5-14-16(9-12)30-21(28)25-14/h3,5,9-11H,1-2,4,6-8H2,(H,25,28)(H,22,23,24)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218733
PNG
(US9296757, 55)
Show SMILES O=C(C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21)N1Cc2ccccc2C1
Show InChI InChI=1S/C26H21N5O2S2/c32-25(31-11-15-3-1-2-4-16(15)12-31)14-5-7-18-20(9-14)34-24-22(18)23(27-13-28-24)29-17-6-8-19-21(10-17)35-26(33)30-19/h1-4,6,8,10,13-14H,5,7,9,11-12H2,(H,30,33)(H,27,28,29)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218729
PNG
(US9296757, 51)
Show SMILES OC1CCN(C1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C22H21N5O3S2/c28-13-5-6-27(9-13)21(29)11-1-3-14-16(7-11)31-20-18(14)19(23-10-24-20)25-12-2-4-15-17(8-12)32-22(30)26-15/h2,4,8,10-11,13,28H,1,3,5-7,9H2,(H,26,30)(H,23,24,25)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218743
PNG
(US9296757, 65)
Show SMILES FC1CCCN(C1)C(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C23H22FN5O2S2/c24-13-2-1-7-29(10-13)22(30)12-3-5-15-17(8-12)32-21-19(15)20(25-11-26-21)27-14-4-6-16-18(9-14)33-23(31)28-16/h4,6,9,11-13H,1-3,5,7-8,10H2,(H,28,31)(H,25,26,27)
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n/an/a 81n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218704
PNG
(US9296757, 26)
Show SMILES CC(O)C(=O)NCC1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C21H21N5O3S2/c1-10(27)19(28)22-8-11-2-4-13-15(6-11)30-20-17(13)18(23-9-24-20)25-12-3-5-14-16(7-12)31-21(29)26-14/h3,5,7,9-11,27H,2,4,6,8H2,1H3,(H,22,28)(H,26,29)(H,23,24,25)
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n/an/a 84n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218693
PNG
(US9296757, 15)
Show SMILES FC(F)(F)CNC(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C20H16F3N5O2S2/c21-20(22,23)7-24-17(29)9-1-3-11-13(5-9)31-18-15(11)16(25-8-26-18)27-10-2-4-12-14(6-10)32-19(30)28-12/h2,4,6,8-9H,1,3,5,7H2,(H,24,29)(H,28,30)(H,25,26,27)
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n/an/a 85n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218689
PNG
(US9296757, 11)
Show SMILES CNC(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C19H17N5O2S2/c1-20-17(25)9-2-4-11-13(6-9)27-18-15(11)16(21-8-22-18)23-10-3-5-12-14(7-10)28-19(26)24-12/h3,5,7-9H,2,4,6H2,1H3,(H,20,25)(H,24,26)(H,21,22,23)
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n/an/a 91n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218710
PNG
(US9296757, 32)
Show SMILES N[C@@H](CCO)C(=O)NCC1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C22H24N6O3S2/c23-14(5-6-29)20(30)24-9-11-1-3-13-16(7-11)32-21-18(13)19(25-10-26-21)27-12-2-4-15-17(8-12)33-22(31)28-15/h2,4,8,10-11,14,29H,1,3,5-7,9,23H2,(H,24,30)(H,28,31)(H,25,26,27)/t11?,14-/m0/s1
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n/an/a 92n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218697
PNG
(US9296757, 19)
Show SMILES [N-]=[N+]=NCC1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C18H15N7OS2/c19-25-22-7-9-1-3-11-13(5-9)27-17-15(11)16(20-8-21-17)23-10-2-4-12-14(6-10)28-18(26)24-12/h2,4,6,8-9H,1,3,5,7H2,(H,24,26)(H,20,21,23)
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n/an/a 93n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218705
PNG
(US9296757, 27)
Show SMILES CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)NCC1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C27H32N6O5S2/c1-27(2,3)38-25(36)32-18(8-9-34)23(35)28-12-14-4-6-16-19(10-14)39-24-21(16)22(29-13-30-24)31-15-5-7-17-20(11-15)40-26(37)33-17/h5,7,11,13-14,18,34H,4,6,8-10,12H2,1-3H3,(H,28,35)(H,32,36)(H,33,37)(H,29,30,31)/t14?,18-/m0/s1
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n/an/a 100n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218698
PNG
(US9296757, 20)
Show SMILES NCC1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C18H17N5OS2/c19-7-9-1-3-11-13(5-9)25-17-15(11)16(20-8-21-17)22-10-2-4-12-14(6-10)26-18(24)23-12/h2,4,6,8-9H,1,3,5,7,19H2,(H,23,24)(H,20,21,22)
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BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218680
PNG
(US9296757, 18 | US9296757, 2)
Show SMILES OC(=O)C1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C18H14N4O3S2/c23-17(24)8-1-3-10-12(5-8)26-16-14(10)15(19-7-20-16)21-9-2-4-11-13(6-9)27-18(25)22-11/h2,4,6-8H,1,3,5H2,(H,22,25)(H,23,24)(H,19,20,21)
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n/an/a 108n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218695
PNG
(US9296757, 17)
Show SMILES CC1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C18H16N4OS2/c1-9-2-4-11-13(6-9)24-17-15(11)16(19-8-20-17)21-10-3-5-12-14(7-10)25-18(23)22-12/h3,5,7-9H,2,4,6H2,1H3,(H,22,23)(H,19,20,21)
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n/an/a 128n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218706
PNG
(US9296757, 28)
Show SMILES CC(C)S(=O)(=O)NCC1CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21
Show InChI InChI=1S/C21H23N5O3S3/c1-11(2)32(28,29)24-9-12-3-5-14-16(7-12)30-20-18(14)19(22-10-23-20)25-13-4-6-15-17(8-13)31-21(27)26-15/h4,6,8,10-12,24H,3,5,7,9H2,1-2H3,(H,26,27)(H,22,23,25)
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n/an/a 139n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


Citation and Details
More data for this
Ligand-Target Pair
GST-MKNK1


(Homo sapiens (Human))
BDBM218694
PNG
(US9296757, 16)
Show SMILES COCC1(CCc2c(C1)sc1ncnc(Nc3ccc4[nH]c(=O)sc4c3)c21)OC
Show InChI InChI=1S/C20H20N4O3S2/c1-26-9-20(27-2)6-5-12-15(8-20)28-18-16(12)17(21-10-22-18)23-11-3-4-13-14(7-11)29-19(25)24-13/h3-4,7,10H,5-6,8-9H2,1-2H3,(H,24,25)(H,21,22,23)
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n/an/a 304n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For the assay 50 nL of a 100 fold concentrated solution of the test compound in DMSO was pipetted into a black low volume 384 well microtiter plate (...


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