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Patent code US9714244

Compile Data Set for Download or QSAR
Found 46 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
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264269
PNG
(6-(2,6-Dichlorophenyl)-2-((4-(piperazin-1-yl)pheny...)
Show SMILES Clc1cccc(Cl)c1-n1cc(-c2cccnc2)c2nc(Nc3ccc(cc3)N3CCNCC3)ncc2c1=O
Show InChI InChI=1S/C28H23Cl2N7O/c29-23-4-1-5-24(30)26(23)37-17-22(18-3-2-10-32-15-18)25-21(27(37)38)16-33-28(35-25)34-19-6-8-20(9-7-19)36-13-11-31-12-14-36/h1-10,15-17,31H,11-14H2,(H,33,34,35)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM264259
PNG
(6-(2,6-Dichlorophenyl)-2-((3-methoxy-4-(piperazin-...)
Show SMILES COc1cc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)ccc1N1CCNCC1
Show InChI InChI=1S/C24H22Cl2N6O2/c1-34-21-13-15(5-6-20(21)31-11-8-27-9-12-31)29-24-28-14-16-19(30-24)7-10-32(23(16)33)22-17(25)3-2-4-18(22)26/h2-7,10,13-14,27H,8-9,11-12H2,1H3,(H,28,29,30)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
Compounds were tested for inhibition of the human ether a go-go related gene (hERG) K+ channel using IonWorks patch clamp electrophysiology at Essen ...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264255
PNG
(8-Bromo-6-(2,6-dichlorophenyl)-2-((4-(piperazin-1-...)
Show SMILES Clc1cccc(Cl)c1-n1cc(Br)c2nc(Nc3ccc(cc3)N3CCNCC3)ncc2c1=O
Show InChI InChI=1S/C23H19BrCl2N6O/c24-17-13-32(21-18(25)2-1-3-19(21)26)22(33)16-12-28-23(30-20(16)17)29-14-4-6-15(7-5-14)31-10-8-27-9-11-31/h1-7,12-13,27H,8-11H2,(H,28,29,30)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM264265
PNG
(6-(2,6-Dichlorophenyl)-2-((4-morpholinophenyl)amin...)
Show SMILES Clc1cccc(Cl)c1-n1ccc2nc(Nc3ccc(cc3)N3CCOCC3)ncc2c1=O
Show InChI InChI=1S/C23H19Cl2N5O2/c24-18-2-1-3-19(25)21(18)30-9-8-20-17(22(30)31)14-26-23(28-20)27-15-4-6-16(7-5-15)29-10-12-32-13-11-29/h1-9,14H,10-13H2,(H,26,27,28)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
Compounds were tested for inhibition of the human ether a go-go related gene (hERG) K+ channel using IonWorks patch clamp electrophysiology at Essen ...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM264247
PNG
(6-(2,6-Dichlorophenyl)-8-methyl-2-((4-(piperazin-1...)
Show SMILES Cc1cn(-c2c(Cl)cccc2Cl)c(=O)c2cnc(Nc3ccc(cc3)N3CCNCC3)nc12
Show InChI InChI=1S/C24H22Cl2N6O/c1-15-14-32(22-19(25)3-2-4-20(22)26)23(33)18-13-28-24(30-21(15)18)29-16-5-7-17(8-6-16)31-11-9-27-10-12-31/h2-8,13-14,27H,9-12H2,1H3,(H,28,29,30)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
Compounds were tested for inhibition of the human ether a go-go related gene (hERG) K+ channel using IonWorks patch clamp electrophysiology at Essen ...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264270
PNG
(6-(2-Chlorophenyl)-2-((3-methyl-4-(piperazin-1-yl)...)
Show SMILES Cc1cc(Nc2ncc3c(ccn(-c4ccccc4Cl)c3=O)n2)ccc1N1CCNCC1
Show InChI InChI=1S/C24H23ClN6O/c1-16-14-17(6-7-21(16)30-12-9-26-10-13-30)28-24-27-15-18-20(29-24)8-11-31(23(18)32)22-5-3-2-4-19(22)25/h2-8,11,14-15,26H,9-10,12-13H2,1H3,(H,27,28,29)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264268
PNG
(8-(3-Aminoprop-1-yn-1-yl)-6-(2,6-dichlorophenyl)-2...)
Show SMILES NCC#Cc1cn(-c2c(Cl)cccc2Cl)c(=O)c2cnc(Nc3ccc(cc3)N3CCOCC3)nc12
Show InChI InChI=1S/C26H22Cl2N6O2/c27-21-4-1-5-22(28)24(21)34-16-17(3-2-10-29)23-20(25(34)35)15-30-26(32-23)31-18-6-8-19(9-7-18)33-11-13-36-14-12-33/h1,4-9,15-16H,10-14,29H2,(H,30,31,32)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264273
PNG
(2-((3-Chloro-4-(piperazin-1-yl)phenyl)amino)-6-(2,...)
Show SMILES Clc1cccc(Cl)c1-n1ccc2nc(Nc3ccc(N4CCNCC4)c(Cl)c3)ncc2c1=O
Show InChI InChI=1S/C23H19Cl3N6O/c24-16-2-1-3-17(25)21(16)32-9-6-19-15(22(32)33)13-28-23(30-19)29-14-4-5-20(18(26)12-14)31-10-7-27-8-11-31/h1-6,9,12-13,27H,7-8,10-11H2,(H,28,29,30)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264267
PNG
(6-(2,6-Dichlorophenyl)-2-((4-(4-(2-hydroxyethyl)pi...)
Show SMILES OCCN1CCN(CC1)c1ccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cc1
Show InChI InChI=1S/C25H24Cl2N6O2/c26-20-2-1-3-21(27)23(20)33-9-8-22-19(24(33)35)16-28-25(30-22)29-17-4-6-18(7-5-17)32-12-10-31(11-13-32)14-15-34/h1-9,16,34H,10-15H2,(H,28,29,30)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM264262
PNG
(6-(2,6-Dichlorophenyl)-2-((4-(2-(methylamino)ethox...)
Show SMILES CNCCOc1ccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cc1
Show InChI InChI=1S/C22H19Cl2N5O2/c1-25-10-12-31-15-7-5-14(6-8-15)27-22-26-13-16-19(28-22)9-11-29(21(16)30)20-17(23)3-2-4-18(20)24/h2-9,11,13,25H,10,12H2,1H3,(H,26,27,28)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
Compounds were tested for inhibition of the human ether a go-go related gene (hERG) K+ channel using IonWorks patch clamp electrophysiology at Essen ...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM264264
PNG
(6-(2,6-Dichlorophenyl)-2-((3-(hydroxymethyl)-4-(pi...)
Show SMILES OCc1cc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)ccc1N1CCNCC1
Show InChI InChI=1S/C24H22Cl2N6O2/c25-18-2-1-3-19(26)22(18)32-9-6-20-17(23(32)34)13-28-24(30-20)29-16-4-5-21(15(12-16)14-33)31-10-7-27-8-11-31/h1-6,9,12-13,27,33H,7-8,10-11,14H2,(H,28,29,30)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
Compounds were tested for inhibition of the human ether a go-go related gene (hERG) K+ channel using IonWorks patch clamp electrophysiology at Essen ...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM264266
PNG
(6-(2,6-Dichlorophenyl)-2-((3-((methylamino)methyl)...)
Show SMILES CNCc1cc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)ccc1N1CCOCC1
Show InChI InChI=1S/C25H24Cl2N6O2/c1-28-14-16-13-17(5-6-22(16)32-9-11-35-12-10-32)30-25-29-15-18-21(31-25)7-8-33(24(18)34)23-19(26)3-2-4-20(23)27/h2-8,13,15,28H,9-12,14H2,1H3,(H,29,30,31)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
Compounds were tested for inhibition of the human ether a go-go related gene (hERG) K+ channel using IonWorks patch clamp electrophysiology at Essen ...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264260
PNG
(6-(2,6-Dichlorophenyl)-8-(3-hydroxyprop-1-yn-1-yl)...)
Show SMILES Cc1cc(Nc2ncc3c(n2)c(cn(-c2c(Cl)cccc2Cl)c3=O)C#CCO)ccc1N1CCNCC1
Show InChI InChI=1S/C27H24Cl2N6O2/c1-17-14-19(7-8-23(17)34-11-9-30-10-12-34)32-27-31-15-20-24(33-27)18(4-3-13-36)16-35(26(20)37)25-21(28)5-2-6-22(25)29/h2,5-8,14-16,30,36H,9-13H2,1H3,(H,31,32,33)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264275
PNG
(6-(2,6-Dichlorophenyl)-2-((3-fluoro-4-(piperazin-1...)
Show SMILES Fc1cc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)ccc1N1CCNCC1
Show InChI InChI=1S/C23H19Cl2FN6O/c24-16-2-1-3-17(25)21(16)32-9-6-19-15(22(32)33)13-28-23(30-19)29-14-4-5-20(18(26)12-14)31-10-7-27-8-11-31/h1-6,9,12-13,27H,7-8,10-11H2,(H,28,29,30)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264251
PNG
(6-(2,6-Dichlorophenyl)-2-((4-(1,1-dioxidothiomorph...)
Show SMILES Clc1cccc(Cl)c1-n1ccc2nc(Nc3ccc(cc3)N3CCS(=O)(=O)CC3)ncc2c1=O
Show InChI InChI=1S/C23H19Cl2N5O3S/c24-18-2-1-3-19(25)21(18)30-9-8-20-17(22(30)31)14-26-23(28-20)27-15-4-6-16(7-5-15)29-10-12-34(32,33)13-11-29/h1-9,14H,10-13H2,(H,26,27,28)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM264252
PNG
(6-(2,6-Dichlorophenyl)-2-((3-methyl-4-(piperazin-1...)
Show SMILES Cc1cc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)ccc1N1CCNCC1
Show InChI InChI=1S/C24H22Cl2N6O/c1-15-13-16(5-6-21(15)31-11-8-27-9-12-31)29-24-28-14-17-20(30-24)7-10-32(23(17)33)22-18(25)3-2-4-19(22)26/h2-7,10,13-14,27H,8-9,11-12H2,1H3,(H,28,29,30)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
Compounds were tested for inhibition of the human ether a go-go related gene (hERG) K+ channel using IonWorks patch clamp electrophysiology at Essen ...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264271
PNG
(2-((3-(Aminomethyl)phenyl)amino)-6-(2,6-dichloroph...)
Show SMILES NCc1cccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)c1
Show InChI InChI=1S/C20H15Cl2N5O/c21-15-5-2-6-16(22)18(15)27-8-7-17-14(19(27)28)11-24-20(26-17)25-13-4-1-3-12(9-13)10-23/h1-9,11H,10,23H2,(H,24,25,26)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264279
PNG
(2-(4-(4-((6-(2,6-Dichlorophenyl)-5-oxo-5,6-dihydro...)
Show SMILES OC(=O)CN1CCN(CC1)c1ccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cc1
Show InChI InChI=1S/C25H22Cl2N6O3/c26-19-2-1-3-20(27)23(19)33-9-8-21-18(24(33)36)14-28-25(30-21)29-16-4-6-17(7-5-16)32-12-10-31(11-13-32)15-22(34)35/h1-9,14H,10-13,15H2,(H,34,35)(H,28,29,30)
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n/an/a 105n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264246
PNG
(6-(2,6-Dichlorophenyl)-2-((4-(piperazin-1-yl)pheny...)
Show SMILES Clc1cccc(Cl)c1-n1ccc2nc(Nc3ccc(cc3)N3CCNCC3)ncc2c1=O
Show InChI InChI=1S/C23H20Cl2N6O/c24-18-2-1-3-19(25)21(18)31-11-8-20-17(22(31)32)14-27-23(29-20)28-15-4-6-16(7-5-15)30-12-9-26-10-13-30/h1-8,11,14,26H,9-10,12-13H2,(H,27,28,29)
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n/an/a 105n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM264258
PNG
(6-(2,6-Dichlorophenyl)-2-((3-methoxy-4-(4-methylpi...)
Show SMILES COc1cc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)ccc1N1CCN(C)CC1
Show InChI InChI=1S/C25H24Cl2N6O2/c1-31-10-12-32(13-11-31)21-7-6-16(14-22(21)35-2)29-25-28-15-17-20(30-25)8-9-33(24(17)34)23-18(26)4-3-5-19(23)27/h3-9,14-15H,10-13H2,1-2H3,(H,28,29,30)
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n/an/a 105n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
Compounds were tested for inhibition of the human ether a go-go related gene (hERG) K+ channel using IonWorks patch clamp electrophysiology at Essen ...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM264257
PNG
(6-(2,6-Dichlorophenyl)-2-((4-(2-(dimethylamino)eth...)
Show SMILES CN(C)CCc1ccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cc1
Show InChI InChI=1S/C23H21Cl2N5O/c1-29(2)12-10-15-6-8-16(9-7-15)27-23-26-14-17-20(28-23)11-13-30(22(17)31)21-18(24)4-3-5-19(21)25/h3-9,11,13-14H,10,12H2,1-2H3,(H,26,27,28)
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n/an/a 105n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
Compounds were tested for inhibition of the human ether a go-go related gene (hERG) K+ channel using IonWorks patch clamp electrophysiology at Essen ...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM264256
PNG
(6-(2,6-Dichlorophenyl)-2-((4-(1-methylpiperidin-4-...)
Show SMILES CN1CCC(CC1)c1ccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cc1
Show InChI InChI=1S/C25H23Cl2N5O/c1-31-12-9-17(10-13-31)16-5-7-18(8-6-16)29-25-28-15-19-22(30-25)11-14-32(24(19)33)23-20(26)3-2-4-21(23)27/h2-8,11,14-15,17H,9-10,12-13H2,1H3,(H,28,29,30)
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n/an/a 105n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
Compounds were tested for inhibition of the human ether a go-go related gene (hERG) K+ channel using IonWorks patch clamp electrophysiology at Essen ...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264250
PNG
(2-((4-(4-Acetylpiperazin-1-yl)phenyl)amino)-6-(2,6...)
Show SMILES CC(=O)N1CCN(CC1)c1ccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cc1
Show InChI InChI=1S/C25H22Cl2N6O2/c1-16(34)31-11-13-32(14-12-31)18-7-5-17(6-8-18)29-25-28-15-19-22(30-25)9-10-33(24(19)35)23-20(26)3-2-4-21(23)27/h2-10,15H,11-14H2,1H3,(H,28,29,30)
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n/an/a 105n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264249
PNG
(6-(2,6-Dichlorophenyl)-2-((4-(2-(diethylamino)etho...)
Show SMILES CCN(CC)CCOc1ccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cc1
Show InChI InChI=1S/C25H25Cl2N5O2/c1-3-31(4-2)14-15-34-18-10-8-17(9-11-18)29-25-28-16-19-22(30-25)12-13-32(24(19)33)23-20(26)6-5-7-21(23)27/h5-13,16H,3-4,14-15H2,1-2H3,(H,28,29,30)
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n/an/a 105n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264278
PNG
(6-(2,6-Dichlorophenyl)-2-((4-(4-methylpiperazine-1...)
Show SMILES CN1CCN(CC1)C(=O)c1ccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cc1
Show InChI InChI=1S/C25H22Cl2N6O2/c1-31-11-13-32(14-12-31)23(34)16-5-7-17(8-6-16)29-25-28-15-18-21(30-25)9-10-33(24(18)35)22-19(26)3-2-4-20(22)27/h2-10,15H,11-14H2,1H3,(H,28,29,30)
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n/an/a 105n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264277
PNG
(6-(2,6-Dichlorophenyl)-2-((6-(4-methylpiperazin-1-...)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cn1
Show InChI InChI=1S/C23H21Cl2N7O/c1-30-9-11-31(12-10-30)20-6-5-15(13-26-20)28-23-27-14-16-19(29-23)7-8-32(22(16)33)21-17(24)3-2-4-18(21)25/h2-8,13-14H,9-12H2,1H3,(H,27,28,29)
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n/an/a 105n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264276
PNG
(6-(2,6-Dichlorophenyl)-2-((3,5-difluoro-4-(piperaz...)
Show SMILES Fc1cc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cc(F)c1N1CCNCC1
Show InChI InChI=1S/C23H18Cl2F2N6O/c24-15-2-1-3-16(25)20(15)33-7-4-19-14(22(33)34)12-29-23(31-19)30-13-10-17(26)21(18(27)11-13)32-8-5-28-6-9-32/h1-4,7,10-12,28H,5-6,8-9H2,(H,29,30,31)
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n/an/a 105n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM264261
PNG
(6-(2,6-Dichlorophenyl)-2-((4-(4-methylpiperazin-1-...)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cc1
Show InChI InChI=1S/C24H22Cl2N6O/c1-30-11-13-31(14-12-30)17-7-5-16(6-8-17)28-24-27-15-18-21(29-24)9-10-32(23(18)33)22-19(25)3-2-4-20(22)26/h2-10,15H,11-14H2,1H3,(H,27,28,29)
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n/an/a 105n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
Compounds were tested for inhibition of the human ether a go-go related gene (hERG) K+ channel using IonWorks patch clamp electrophysiology at Essen ...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264272
PNG
(6-(2,6-Dichlorophenyl)-2-((3-(4-methylpiperazin-1-...)
Show SMILES CN1CCN(CC1)c1cccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)c1
Show InChI InChI=1S/C24H22Cl2N6O/c1-30-10-12-31(13-11-30)17-5-2-4-16(14-17)28-24-27-15-18-21(29-24)8-9-32(23(18)33)22-19(25)6-3-7-20(22)26/h2-9,14-15H,10-13H2,1H3,(H,27,28,29)
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n/an/a 105n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM264263
PNG
(6-(2,6-Dichlorophenyl)-2-((4-(4-isopropylpiperazin...)
Show SMILES CC(C)N1CCN(CC1)c1ccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cc1
Show InChI InChI=1S/C26H26Cl2N6O/c1-17(2)32-12-14-33(15-13-32)19-8-6-18(7-9-19)30-26-29-16-20-23(31-26)10-11-34(25(20)35)24-21(27)4-3-5-22(24)28/h3-11,16-17H,12-15H2,1-2H3,(H,29,30,31)
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n/an/a 105n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
Compounds were tested for inhibition of the human ether a go-go related gene (hERG) K+ channel using IonWorks patch clamp electrophysiology at Essen ...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264248
PNG
(6-(2-Chloropyridin-3-yl)-2-((4-(piperazin-1-yl)phe...)
Show SMILES Clc1ncccc1-n1ccc2nc(Nc3ccc(cc3)N3CCNCC3)ncc2c1=O
Show InChI InChI=1S/C22H20ClN7O/c23-20-19(2-1-8-25-20)30-11-7-18-17(21(30)31)14-26-22(28-18)27-15-3-5-16(6-4-15)29-12-9-24-10-13-29/h1-8,11,14,24H,9-10,12-13H2,(H,26,27,28)
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n/an/a>200n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264274
PNG
(N-(6-(2,6-Dichlorophenyl)-5-oxo-2-((4-(piperazin-1...)
Show SMILES CC(=O)Nc1cn(-c2c(Cl)cccc2Cl)c(=O)c2cnc(Nc3ccc(cc3)N3CCNCC3)nc12
Show InChI InChI=1S/C25H23Cl2N7O2/c1-15(35)30-21-14-34(23-19(26)3-2-4-20(23)27)24(36)18-13-29-25(32-22(18)21)31-16-5-7-17(8-6-16)33-11-9-28-10-12-33/h2-8,13-14,28H,9-12H2,1H3,(H,30,35)(H,29,31,32)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM264254
PNG
(6-(2,6-Dichlorophenyl)-2-((3-(hydroxymethyl)-4-(4-...)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cc1CO
Show InChI InChI=1S/C25H24Cl2N6O2/c1-31-9-11-32(12-10-31)22-6-5-17(13-16(22)15-34)29-25-28-14-18-21(30-25)7-8-33(24(18)35)23-19(26)3-2-4-20(23)27/h2-8,13-14,34H,9-12,15H2,1H3,(H,28,29,30)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
Compounds were tested for inhibition of the human ether a go-go related gene (hERG) K+ channel using IonWorks patch clamp electrophysiology at Essen ...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264265
PNG
(6-(2,6-Dichlorophenyl)-2-((4-morpholinophenyl)amin...)
Show SMILES Clc1cccc(Cl)c1-n1ccc2nc(Nc3ccc(cc3)N3CCOCC3)ncc2c1=O
Show InChI InChI=1S/C23H19Cl2N5O2/c24-18-2-1-3-19(25)21(18)30-9-8-20-17(22(30)31)14-26-23(28-20)27-15-4-6-16(7-5-15)29-10-12-32-13-11-29/h1-9,14H,10-13H2,(H,26,27,28)
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n/an/a 5.50E+3n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264261
PNG
(6-(2,6-Dichlorophenyl)-2-((4-(4-methylpiperazin-1-...)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cc1
Show InChI InChI=1S/C24H22Cl2N6O/c1-30-11-13-31(14-12-30)17-7-5-16(6-8-17)28-24-27-15-18-21(29-24)9-10-32(23(18)33)22-19(25)3-2-4-20(22)26/h2-10,15H,11-14H2,1H3,(H,27,28,29)
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n/an/a 5.50E+3n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264263
PNG
(6-(2,6-Dichlorophenyl)-2-((4-(4-isopropylpiperazin...)
Show SMILES CC(C)N1CCN(CC1)c1ccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cc1
Show InChI InChI=1S/C26H26Cl2N6O/c1-17(2)32-12-14-33(15-13-32)19-8-6-18(7-9-19)30-26-29-16-20-23(31-26)10-11-34(25(20)35)24-21(27)4-3-5-22(24)28/h3-11,16-17H,12-15H2,1-2H3,(H,29,30,31)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264258
PNG
(6-(2,6-Dichlorophenyl)-2-((3-methoxy-4-(4-methylpi...)
Show SMILES COc1cc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)ccc1N1CCN(C)CC1
Show InChI InChI=1S/C25H24Cl2N6O2/c1-31-10-12-32(13-11-31)21-7-6-16(14-22(21)35-2)29-25-28-15-17-20(30-25)8-9-33(24(17)34)23-18(26)4-3-5-19(23)27/h3-9,14-15H,10-13H2,1-2H3,(H,28,29,30)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264257
PNG
(6-(2,6-Dichlorophenyl)-2-((4-(2-(dimethylamino)eth...)
Show SMILES CN(C)CCc1ccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cc1
Show InChI InChI=1S/C23H21Cl2N5O/c1-29(2)12-10-15-6-8-16(9-7-15)27-23-26-14-17-20(28-23)11-13-30(22(17)31)21-18(24)4-3-5-19(21)25/h3-9,11,13-14H,10,12H2,1-2H3,(H,26,27,28)
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ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264262
PNG
(6-(2,6-Dichlorophenyl)-2-((4-(2-(methylamino)ethox...)
Show SMILES CNCCOc1ccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cc1
Show InChI InChI=1S/C22H19Cl2N5O2/c1-25-10-12-31-15-7-5-14(6-8-15)27-22-26-13-16-19(28-22)9-11-29(21(16)30)20-17(23)3-2-4-18(20)24/h2-9,11,13,25H,10,12H2,1H3,(H,26,27,28)
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n/an/a 5.50E+3n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264252
PNG
(6-(2,6-Dichlorophenyl)-2-((3-methyl-4-(piperazin-1...)
Show SMILES Cc1cc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)ccc1N1CCNCC1
Show InChI InChI=1S/C24H22Cl2N6O/c1-15-13-16(5-6-21(15)31-11-8-27-9-12-31)29-24-28-14-17-20(30-24)7-10-32(23(17)33)22-18(25)3-2-4-19(22)26/h2-7,10,13-14,27H,8-9,11-12H2,1H3,(H,28,29,30)
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n/an/a>1.00E+4n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264266
PNG
(6-(2,6-Dichlorophenyl)-2-((3-((methylamino)methyl)...)
Show SMILES CNCc1cc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)ccc1N1CCOCC1
Show InChI InChI=1S/C25H24Cl2N6O2/c1-28-14-16-13-17(5-6-22(16)32-9-11-35-12-10-32)30-25-29-15-18-21(31-25)7-8-33(24(18)34)23-19(26)3-2-4-20(23)27/h2-8,13,15,28H,9-12,14H2,1H3,(H,29,30,31)
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n/an/a>1.00E+4n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264254
PNG
(6-(2,6-Dichlorophenyl)-2-((3-(hydroxymethyl)-4-(4-...)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cc1CO
Show InChI InChI=1S/C25H24Cl2N6O2/c1-31-9-11-32(12-10-31)22-6-5-17(13-16(22)15-34)29-25-28-14-18-21(30-25)7-8-33(24(18)35)23-19(26)3-2-4-20(23)27/h2-8,13-14,34H,9-12,15H2,1H3,(H,28,29,30)
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n/an/a>1.00E+4n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264259
PNG
(6-(2,6-Dichlorophenyl)-2-((3-methoxy-4-(piperazin-...)
Show SMILES COc1cc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)ccc1N1CCNCC1
Show InChI InChI=1S/C24H22Cl2N6O2/c1-34-21-13-15(5-6-20(21)31-11-8-27-9-12-31)29-24-28-14-16-19(30-24)7-10-32(23(16)33)22-17(25)3-2-4-18(22)26/h2-7,10,13-14,27H,8-9,11-12H2,1H3,(H,28,29,30)
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n/an/a>1.00E+4n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264247
PNG
(6-(2,6-Dichlorophenyl)-8-methyl-2-((4-(piperazin-1...)
Show SMILES Cc1cn(-c2c(Cl)cccc2Cl)c(=O)c2cnc(Nc3ccc(cc3)N3CCNCC3)nc12
Show InChI InChI=1S/C24H22Cl2N6O/c1-15-14-32(22-19(25)3-2-4-20(22)26)23(33)18-13-28-24(30-21(15)18)29-16-5-7-17(8-6-16)31-11-9-27-10-12-31/h2-8,13-14,27H,9-12H2,1H3,(H,28,29,30)
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n/an/a>1.00E+4n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264264
PNG
(6-(2,6-Dichlorophenyl)-2-((3-(hydroxymethyl)-4-(pi...)
Show SMILES OCc1cc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)ccc1N1CCNCC1
Show InChI InChI=1S/C24H22Cl2N6O2/c25-18-2-1-3-19(26)22(18)32-9-6-20-17(23(32)34)13-28-24(30-20)29-16-4-5-21(15(12-16)14-33)31-10-7-27-8-11-31/h1-6,9,12-13,27,33H,7-8,10-11,14H2,(H,28,29,30)
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n/an/a>1.00E+4n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase WEE1


(Homo sapiens)
BDBM264256
PNG
(6-(2,6-Dichlorophenyl)-2-((4-(1-methylpiperidin-4-...)
Show SMILES CN1CCC(CC1)c1ccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cc1
Show InChI InChI=1S/C25H23Cl2N5O/c1-31-12-9-17(10-13-31)16-5-7-18(8-6-16)29-25-28-15-19-22(30-25)11-14-32(24(19)33)23-20(26)3-2-4-21(23)27/h2-8,11,14-15,17H,9-10,12-13H2,1H3,(H,28,29,30)
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n/an/a>1.00E+4n/an/an/an/an/an/a



ALMAC DISCOVERY LIMITED

US Patent


Assay Description
In the measurement of Wee-1 activity, a commercial peptide Poly(Lys Tyr(4:1)) hydrobromide was purchased from Sigma Aldrich and used as the substrate...


US Patent US9714244 (2017)

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