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Patent code US10464927

Compile Data Set for Download or QSAR
Found 98 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
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419866
PNG
(US10464927, Compound I-14)
Show SMILES CN(C)C(=O)c1cc2cc(ccc2n1C1CCCC1)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C29H33FN8O/c1-36(2)28(39)25-16-20-15-19(7-9-24(20)38(25)21-5-3-4-6-21)27-23(30)18-33-29(35-27)34-26-10-8-22(17-32-26)37-13-11-31-12-14-37/h7-10,15-18,21,31H,3-6,11-14H2,1-2H3,(H,32,33,34,35)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419874
PNG
(US10464927, Compound I-22)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4n(C5CCCC5)c(cc4c3)C(=O)N(C)C)nc2)CC1
Show InChI InChI=1S/C32H39FN8O/c1-4-39-13-15-40(16-14-39)21-22-9-12-29(34-19-22)36-32-35-20-26(33)30(37-32)23-10-11-27-24(17-23)18-28(31(42)38(2)3)41(27)25-7-5-6-8-25/h9-12,17-20,25H,4-8,13-16,21H2,1-3H3,(H,34,35,36,37)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419879
PNG
(US10464927, Compound I-27)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4n(C(C)C)c(cc4c3F)C(=O)N(C)C)nc2)CC1
Show InChI InChI=1S/C30H36F2N8O/c1-6-38-11-13-39(14-12-38)18-20-7-10-26(33-16-20)35-30-34-17-23(31)28(36-30)21-8-9-24-22(27(21)32)15-25(29(41)37(4)5)40(24)19(2)3/h7-10,15-17,19H,6,11-14,18H2,1-5H3,(H,33,34,35,36)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419886
PNG
(US10464927, Compound I-34)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4ncc(C#N)n4c3)nc2)CC1
Show InChI InChI=1S/C24H24FN9/c1-2-32-7-9-33(10-8-32)15-17-3-5-21(27-12-17)30-24-29-14-20(25)23(31-24)18-4-6-22-28-13-19(11-26)34(22)16-18/h3-6,12-14,16H,2,7-10,15H2,1H3,(H,27,29,30,31)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419893
PNG
(US10464927, Compound I-41)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ncnc4n(C5CC5)c(cc34)C(C)=O)nc2)CC1
Show InChI InChI=1S/C27H30FN9O/c1-3-35-8-10-36(11-9-35)15-18-4-7-23(29-13-18)33-27-30-14-21(28)25(34-27)24-20-12-22(17(2)38)37(19-5-6-19)26(20)32-16-31-24/h4,7,12-14,16,19H,3,5-6,8-11,15H2,1-2H3,(H,29,30,33,34)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419895
PNG
(US10464927, Compound I-43)
Show SMILES CN(C)C(=O)c1nn(C2CCCC2)c2ccc(cc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C28H32FN9O/c1-36(2)27(39)26-21-15-18(7-9-23(21)38(35-26)19-5-3-4-6-19)25-22(29)17-32-28(34-25)33-24-10-8-20(16-31-24)37-13-11-30-12-14-37/h7-10,15-17,19,30H,3-6,11-14H2,1-2H3,(H,31,32,33,34)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419854
PNG
(US10464927, Compound I-2)
Show SMILES CC(C)n1ccc2cc(ccc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C24H26FN7/c1-16(2)32-10-7-17-13-18(3-5-21(17)32)23-20(25)15-28-24(30-23)29-22-6-4-19(14-27-22)31-11-8-26-9-12-31/h3-7,10,13-16,26H,8-9,11-12H2,1-2H3,(H,27,28,29,30)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419863
PNG
(US10464927, Compound I-11)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ncnc4n(C5CCCC5)c(C)cc34)nc2)CC1
Show InChI InChI=1S/C28H34FN9/c1-3-36-10-12-37(13-11-36)17-20-8-9-24(30-15-20)34-28-31-16-23(29)26(35-28)25-22-14-19(2)38(21-6-4-5-7-21)27(22)33-18-32-25/h8-9,14-16,18,21H,3-7,10-13,17H2,1-2H3,(H,30,31,34,35)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419872
PNG
(US10464927, Compound I-20)
Show SMILES CC(=O)c1cn(C2CCCCCC2)c2ccc(cc12)-c1nc(Nc2ccc(CN3CCN(CC3)C3CCCC3)cn2)ncc1F
Show InChI InChI=1S/C36H44FN7O/c1-25(45)31-24-44(29-10-4-2-3-5-11-29)33-14-13-27(20-30(31)33)35-32(37)22-39-36(41-35)40-34-15-12-26(21-38-34)23-42-16-18-43(19-17-42)28-8-6-7-9-28/h12-15,20-22,24,28-29H,2-11,16-19,23H2,1H3,(H,38,39,40,41)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419877
PNG
(US10464927, Compound I-25)
Show SMILES CC(C)n1c(cc2nc(ccc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F)C(=O)N(C)C
Show InChI InChI=1S/C26H30FN9O/c1-16(2)36-21-7-6-19(31-20(21)13-22(36)25(37)34(3)4)24-18(27)15-30-26(33-24)32-23-8-5-17(14-29-23)35-11-9-28-10-12-35/h5-8,13-16,28H,9-12H2,1-4H3,(H,29,30,32,33)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419882
PNG
(US10464927, Compound I-30)
Show SMILES CC(C)c1n(C)nc2c(Cl)c(ccc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C24H26ClFN8/c1-14(2)23-17-6-5-16(20(25)22(17)32-33(23)3)21-18(26)13-29-24(31-21)30-19-7-4-15(12-28-19)34-10-8-27-9-11-34/h4-7,12-14,27H,8-11H2,1-3H3,(H,28,29,30,31)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419886
PNG
(US10464927, Compound I-34)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4ncc(C#N)n4c3)nc2)CC1
Show InChI InChI=1S/C24H24FN9/c1-2-32-7-9-33(10-8-32)15-17-3-5-21(27-12-17)30-24-29-14-20(25)23(31-24)18-4-6-22-28-13-19(11-26)34(22)16-18/h3-6,12-14,16H,2,7-10,15H2,1H3,(H,27,29,30,31)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419891
PNG
(US10464927, Compound I-39)
Show SMILES CCC(CC)n1c(nc2cnc(nc12)-c1nc(Nc2ccc(CN3CCN(C)CC3)cn2)ncc1F)C(C)C
Show InChI InChI=1S/C28H37FN10/c1-6-20(7-2)39-26(18(3)4)33-22-16-31-25(36-27(22)39)24-21(29)15-32-28(35-24)34-23-9-8-19(14-30-23)17-38-12-10-37(5)11-13-38/h8-9,14-16,18,20H,6-7,10-13,17H2,1-5H3,(H,30,32,34,35)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419899
PNG
(US10464927, Compound I-47)
Show SMILES CC(C)n1c(C)nc2cnc(nc12)-c1nc(Nc2ccc(cn2)N2CCN(C)CC2)ncc1F
Show InChI InChI=1S/C23H27FN10/c1-14(2)34-15(3)28-18-13-26-21(31-22(18)34)20-17(24)12-27-23(30-20)29-19-6-5-16(11-25-19)33-9-7-32(4)8-10-33/h5-6,11-14H,7-10H2,1-4H3,(H,25,27,29,30)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419862
PNG
(US10464927, Compound I-10)
Show SMILES CC(C)n1c(C(=O)N(C)C)c(F)c2c(ncnc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C25H28F2N10O/c1-14(2)37-22(24(38)35(3)4)19(27)18-21(31-13-32-23(18)37)20-16(26)12-30-25(34-20)33-17-6-5-15(11-29-17)36-9-7-28-8-10-36/h5-6,11-14,28H,7-10H2,1-4H3,(H,29,30,33,34)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM6309
PNG
(6-Acetyl-8-cyclopentyl-5-methyl-2-(5-piperazin-1-y...)
Show SMILES CC(=O)c1c(C)c2cnc(Nc3ccc(cn3)N3CCNCC3)nc2n(C2CCCC2)c1=O
Show InChI InChI=1S/C24H29N7O2/c1-15-19-14-27-24(28-20-8-7-18(13-26-20)30-11-9-25-10-12-30)29-22(19)31(17-5-3-4-6-17)23(33)21(15)16(2)32/h7-8,13-14,17,25H,3-6,9-12H2,1-2H3,(H,26,27,28,29)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM6309
PNG
(6-Acetyl-8-cyclopentyl-5-methyl-2-(5-piperazin-1-y...)
Show SMILES CC(=O)c1c(C)c2cnc(Nc3ccc(cn3)N3CCNCC3)nc2n(C2CCCC2)c1=O
Show InChI InChI=1S/C24H29N7O2/c1-15-19-14-27-24(28-20-8-7-18(13-26-20)30-11-9-25-10-12-30)29-22(19)31(17-5-3-4-6-17)23(33)21(15)16(2)32/h7-8,13-14,17,25H,3-6,9-12H2,1-2H3,(H,26,27,28,29)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419870
PNG
(US10464927, Compound I-18)
Show SMILES Fc1cnc(Nc2ccc(CN3CCN(CC3)C3CCCCCC3)cn2)nc1-c1ccc2n(cc(C3CC3)c2c1)C1CCC1
Show InChI InChI=1S/C36H44FN7/c37-32-22-39-36(41-35(32)27-13-14-33-30(20-27)31(26-11-12-26)24-44(33)29-8-5-9-29)40-34-15-10-25(21-38-34)23-42-16-18-43(19-17-42)28-6-3-1-2-4-7-28/h10,13-15,20-22,24,26,28-29H,1-9,11-12,16-19,23H2,(H,38,39,40,41)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419871
PNG
(US10464927, Compound I-19)
Show SMILES Fc1cnc(Nc2ccc(CN3CCN(CC3)C3CCCCC3)cn2)nc1-c1ccc2n(cc(C3CCC3)c2c1)C1CCCCC1
Show InChI InChI=1S/C38H48FN7/c39-34-24-41-38(42-36-17-14-27(23-40-36)25-44-18-20-45(21-19-44)30-10-3-1-4-11-30)43-37(34)29-15-16-35-32(22-29)33(28-8-7-9-28)26-46(35)31-12-5-2-6-13-31/h14-17,22-24,26,28,30-31H,1-13,18-21,25H2,(H,40,41,42,43)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419872
PNG
(US10464927, Compound I-20)
Show SMILES CC(=O)c1cn(C2CCCCCC2)c2ccc(cc12)-c1nc(Nc2ccc(CN3CCN(CC3)C3CCCC3)cn2)ncc1F
Show InChI InChI=1S/C36H44FN7O/c1-25(45)31-24-44(29-10-4-2-3-5-11-29)33-14-13-27(20-30(31)33)35-32(37)22-39-36(41-35)40-34-15-12-26(21-38-34)23-42-16-18-43(19-17-42)28-8-6-7-9-28/h12-15,20-22,24,28-29H,2-11,16-19,23H2,1H3,(H,38,39,40,41)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419873
PNG
(US10464927, Compound I-21)
Show SMILES CC(C)n1c(cc2cc(ccc12)-c1nc(Nc2ccc(cn2)N2CCN(CC2)C2CCC2)ncc1F)C1CCCC1
Show InChI InChI=1S/C33H40FN7/c1-22(2)41-29-12-10-24(18-25(29)19-30(41)23-6-3-4-7-23)32-28(34)21-36-33(38-32)37-31-13-11-27(20-35-31)40-16-14-39(15-17-40)26-8-5-9-26/h10-13,18-23,26H,3-9,14-17H2,1-2H3,(H,35,36,37,38)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419878
PNG
(US10464927, Compound I-26)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4n(C(C)C)c(cc4n3)C(=O)N(C)C)nc2)CC1
Show InChI InChI=1S/C29H36FN9O/c1-6-37-11-13-38(14-12-37)18-20-7-10-26(31-16-20)34-29-32-17-21(30)27(35-29)22-8-9-24-23(33-22)15-25(28(40)36(4)5)39(24)19(2)3/h7-10,15-17,19H,6,11-14,18H2,1-5H3,(H,31,32,34,35)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419855
PNG
(US10464927, Compound I-3)
Show SMILES CC(=O)c1cn(C2CCCC2)c2ccc(cc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C28H30FN7O/c1-18(37)23-17-36(20-4-2-3-5-20)25-8-6-19(14-22(23)25)27-24(29)16-32-28(34-27)33-26-9-7-21(15-31-26)35-12-10-30-11-13-35/h6-9,14-17,20,30H,2-5,10-13H2,1H3,(H,31,32,33,34)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419876
PNG
(US10464927, Compound I-24)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4n(C(C)C)c(cc4c3)C(C)=O)nc2)CC1
Show InChI InChI=1S/C29H34FN7O/c1-5-35-10-12-36(13-11-35)18-21-6-9-27(31-16-21)33-29-32-17-24(30)28(34-29)22-7-8-25-23(14-22)15-26(20(4)38)37(25)19(2)3/h6-9,14-17,19H,5,10-13,18H2,1-4H3,(H,31,32,33,34)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419883
PNG
(US10464927, Compound I-31)
Show SMILES CN(C)C(=O)c1n(C)nc2c(F)c(ccc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C24H25F2N9O/c1-33(2)23(36)22-16-6-5-15(19(26)21(16)32-34(22)3)20-17(25)13-29-24(31-20)30-18-7-4-14(12-28-18)35-10-8-27-9-11-35/h4-7,12-13,27H,8-11H2,1-3H3,(H,28,29,30,31)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419883
PNG
(US10464927, Compound I-31)
Show SMILES CN(C)C(=O)c1n(C)nc2c(F)c(ccc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C24H25F2N9O/c1-33(2)23(36)22-16-6-5-15(19(26)21(16)32-34(22)3)20-17(25)13-29-24(31-20)30-18-7-4-14(12-28-18)35-10-8-27-9-11-35/h4-7,12-13,27H,8-11H2,1-3H3,(H,28,29,30,31)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419889
PNG
(US10464927, Compound I-37)
Show SMILES CN(C)C(=O)c1nc2cnc(nc2n1C1CCCC1)-c1nc(Nc2ccc(cn2)N2CCN(C)CC2)ncc1F
Show InChI InChI=1S/C27H32FN11O/c1-36(2)26(40)25-32-20-16-30-23(35-24(20)39(25)17-6-4-5-7-17)22-19(28)15-31-27(34-22)33-21-9-8-18(14-29-21)38-12-10-37(3)11-13-38/h8-9,14-17H,4-7,10-13H2,1-3H3,(H,29,31,33,34)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419890
PNG
(US10464927, Compound I-38)
Show SMILES CC(C)n1c(nc2cnc(nc12)-c1nc(Nc2ccc(CN3CCN(C)CC3)cn2)ncc1F)C(C)=O
Show InChI InChI=1S/C25H29FN10O/c1-15(2)36-23(16(3)37)30-19-13-28-22(33-24(19)36)21-18(26)12-29-25(32-21)31-20-6-5-17(11-27-20)14-35-9-7-34(4)8-10-35/h5-6,11-13,15H,7-10,14H2,1-4H3,(H,27,29,31,32)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419890
PNG
(US10464927, Compound I-38)
Show SMILES CC(C)n1c(nc2cnc(nc12)-c1nc(Nc2ccc(CN3CCN(C)CC3)cn2)ncc1F)C(C)=O
Show InChI InChI=1S/C25H29FN10O/c1-15(2)36-23(16(3)37)30-19-13-28-22(33-24(19)36)21-18(26)12-29-25(32-21)31-20-6-5-17(11-27-20)14-35-9-7-34(4)8-10-35/h5-6,11-13,15H,7-10,14H2,1-4H3,(H,27,29,31,32)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419892
PNG
(US10464927, Compound I-40)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ncc4nc(C(=O)N(C)C)n(C)c4n3)nc2)CC1
Show InChI InChI=1S/C25H30FN11O/c1-5-36-8-10-37(11-9-36)15-16-6-7-19(27-12-16)31-25-29-13-17(26)20(32-25)21-28-14-18-22(33-21)35(4)23(30-18)24(38)34(2)3/h6-7,12-14H,5,8-11,15H2,1-4H3,(H,27,29,31,32)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419853
PNG
(US10464927, Compound I-1)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4n(ccc4c3)C(C)C)nc2)CC1
Show InChI InChI=1S/C27H32FN7/c1-4-33-11-13-34(14-12-33)18-20-5-8-25(29-16-20)31-27-30-17-23(28)26(32-27)22-6-7-24-21(15-22)9-10-35(24)19(2)3/h5-10,15-17,19H,4,11-14,18H2,1-3H3,(H,29,30,31,32)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419855
PNG
(US10464927, Compound I-3)
Show SMILES CC(=O)c1cn(C2CCCC2)c2ccc(cc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C28H30FN7O/c1-18(37)23-17-36(20-4-2-3-5-20)25-8-6-19(14-22(23)25)27-24(29)16-32-28(34-27)33-26-9-7-21(15-31-26)35-12-10-30-11-13-35/h6-9,14-17,20,30H,2-5,10-13H2,1H3,(H,31,32,33,34)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419857
PNG
(US10464927, Compound I-5)
Show SMILES Cc1n(C)nc2cc(ccc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C22H23FN8/c1-14-17-5-3-15(11-19(17)29-30(14)2)21-18(23)13-26-22(28-21)27-20-6-4-16(12-25-20)31-9-7-24-8-10-31/h3-6,11-13,24H,7-10H2,1-2H3,(H,25,26,27,28)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419875
PNG
(US10464927, Compound I-23)
Show SMILES CC(C)n1c(cc2cc(ccc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F)C(C)=O
Show InChI InChI=1S/C26H28FN7O/c1-16(2)34-22-6-4-18(12-19(22)13-23(34)17(3)35)25-21(27)15-30-26(32-25)31-24-7-5-20(14-29-24)33-10-8-28-9-11-33/h4-7,12-16,28H,8-11H2,1-3H3,(H,29,30,31,32)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419877
PNG
(US10464927, Compound I-25)
Show SMILES CC(C)n1c(cc2nc(ccc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F)C(=O)N(C)C
Show InChI InChI=1S/C26H30FN9O/c1-16(2)36-21-7-6-19(31-20(21)13-22(36)25(37)34(3)4)24-18(27)15-30-26(33-24)32-23-8-5-17(14-29-23)35-11-9-28-10-12-35/h5-8,13-16,28H,9-12H2,1-4H3,(H,29,30,32,33)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419879
PNG
(US10464927, Compound I-27)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4n(C(C)C)c(cc4c3F)C(=O)N(C)C)nc2)CC1
Show InChI InChI=1S/C30H36F2N8O/c1-6-38-11-13-39(14-12-38)18-20-7-10-26(33-16-20)35-30-34-17-23(31)28(36-30)21-8-9-24-22(27(21)32)15-25(29(41)37(4)5)40(24)19(2)3/h7-10,15-17,19H,6,11-14,18H2,1-5H3,(H,33,34,35,36)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419880
PNG
(US10464927, Compound I-28)
Show SMILES CC(C)n1c(cc2c(F)c(ccc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F)C(=O)N(C)C
Show InChI InChI=1S/C27H30F2N8O/c1-16(2)37-21-7-6-18(24(29)19(21)13-22(37)26(38)35(3)4)25-20(28)15-32-27(34-25)33-23-8-5-17(14-31-23)36-11-9-30-10-12-36/h5-8,13-16,30H,9-12H2,1-4H3,(H,31,32,33,34)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419881
PNG
(US10464927, Compound I-29)
Show SMILES CC(=O)c1n(nc2nc(ccc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F)C1CC1
Show InChI InChI=1S/C24H24FN9O/c1-14(35)22-17-5-6-19(29-23(17)32-34(22)15-2-3-15)21-18(25)13-28-24(31-21)30-20-7-4-16(12-27-20)33-10-8-26-9-11-33/h4-7,12-13,15,26H,2-3,8-11H2,1H3,(H,27,28,30,31)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419884
PNG
(US10464927, Compound I-32)
Show SMILES CC(=O)c1nc(C2CC2)n2cc(cc(F)c12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C25H24F2N8O/c1-14(36)21-23-18(26)10-16(13-35(23)24(32-21)15-2-3-15)22-19(27)12-30-25(33-22)31-20-5-4-17(11-29-20)34-8-6-28-7-9-34/h4-5,10-13,15,28H,2-3,6-9H2,1H3,(H,29,30,31,33)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419885
PNG
(US10464927, Compound I-33)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4nnc(n4c3)C(F)(F)F)nc2)CC1
Show InChI InChI=1S/C23H23F4N9/c1-2-34-7-9-35(10-8-34)13-15-3-5-18(28-11-15)30-22-29-12-17(24)20(31-22)16-4-6-19-32-33-21(23(25,26)27)36(19)14-16/h3-6,11-12,14H,2,7-10,13H2,1H3,(H,28,29,30,31)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419885
PNG
(US10464927, Compound I-33)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4nnc(n4c3)C(F)(F)F)nc2)CC1
Show InChI InChI=1S/C23H23F4N9/c1-2-34-7-9-35(10-8-34)13-15-3-5-18(28-11-15)30-22-29-12-17(24)20(31-22)16-4-6-19-32-33-21(23(25,26)27)36(19)14-16/h3-6,11-12,14H,2,7-10,13H2,1H3,(H,28,29,30,31)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419888
PNG
(US10464927, Compound I-36)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4nnc(C5CC5)n4c3)nc2)CC1
Show InChI InChI=1S/C25H28FN9/c1-2-33-9-11-34(12-10-33)15-17-3-7-21(27-13-17)29-25-28-14-20(26)23(30-25)19-6-8-22-31-32-24(18-4-5-18)35(22)16-19/h3,6-8,13-14,16,18H,2,4-5,9-12,15H2,1H3,(H,27,28,29,30)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419894
PNG
(US10464927, Compound I-42)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ncnc4n(C)cc(C#N)c34)nc2)CC1
Show InChI InChI=1S/C24H25FN10/c1-3-34-6-8-35(9-7-34)13-16-4-5-19(27-11-16)31-24-28-12-18(25)21(32-24)22-20-17(10-26)14-33(2)23(20)30-15-29-22/h4-5,11-12,14-15H,3,6-9,13H2,1-2H3,(H,27,28,31,32)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419859
PNG
(US10464927, Compound I-7)
Show SMILES CC(C)c1nnc2ccc(cn12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C22H24FN9/c1-14(2)21-30-29-19-6-3-15(13-32(19)21)20-17(23)12-26-22(28-20)27-18-5-4-16(11-25-18)31-9-7-24-8-10-31/h3-6,11-14,24H,7-10H2,1-2H3,(H,25,26,27,28)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419859
PNG
(US10464927, Compound I-7)
Show SMILES CC(C)c1nnc2ccc(cn12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C22H24FN9/c1-14(2)21-30-29-19-6-3-15(13-32(19)21)20-17(23)12-26-22(28-20)27-18-5-4-16(11-25-18)31-9-7-24-8-10-31/h3-6,11-14,24H,7-10H2,1-2H3,(H,25,26,27,28)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419856
PNG
(US10464927, Compound I-4)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4n(cc(C(C)=O)c4c3)C3CCCC3)nc2)CC1
Show InChI InChI=1S/C31H36FN7O/c1-3-37-12-14-38(15-13-37)19-22-8-11-29(33-17-22)35-31-34-18-27(32)30(36-31)23-9-10-28-25(16-23)26(21(2)40)20-39(28)24-6-4-5-7-24/h8-11,16-18,20,24H,3-7,12-15,19H2,1-2H3,(H,33,34,35,36)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419857
PNG
(US10464927, Compound I-5)
Show SMILES Cc1n(C)nc2cc(ccc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C22H23FN8/c1-14-17-5-3-15(11-19(17)29-30(14)2)21-18(23)13-26-22(28-21)27-20-6-4-16(12-25-20)31-9-7-24-8-10-31/h3-6,11-13,24H,7-10H2,1-2H3,(H,25,26,27,28)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419888
PNG
(US10464927, Compound I-36)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4nnc(C5CC5)n4c3)nc2)CC1
Show InChI InChI=1S/C25H28FN9/c1-2-33-9-11-34(12-10-33)15-17-3-7-21(27-13-17)29-25-28-14-20(26)23(30-25)19-6-8-22-31-32-24(18-4-5-18)35(22)16-19/h3,6-8,13-14,16,18H,2,4-5,9-12,15H2,1H3,(H,27,28,29,30)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419896
PNG
(US10464927, Compound I-44)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4n(nc(C(C)=O)c4c3)C(C)C)nc2)CC1
Show InChI InChI=1S/C28H33FN8O/c1-5-35-10-12-36(13-11-35)17-20-6-9-25(30-15-20)32-28-31-16-23(29)27(33-28)21-7-8-24-22(14-21)26(19(4)38)34-37(24)18(2)3/h6-9,14-16,18H,5,10-13,17H2,1-4H3,(H,30,31,32,33)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419900
PNG
(US10464927, Compound I-48)
Show SMILES CCN1CCN(CC1)c1ccc(Nc2ncc(F)c(n2)-c2ncc3nc(C)n(C(C)C)c3n2)nc1
Show InChI InChI=1S/C24H29FN10/c1-5-33-8-10-34(11-9-33)17-6-7-20(26-12-17)30-24-28-13-18(25)21(31-24)22-27-14-19-23(32-22)35(15(2)3)16(4)29-19/h6-7,12-15H,5,8-11H2,1-4H3,(H,26,28,30,31)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419858
PNG
(US10464927, Compound I-6)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4nnc(C(C)C)n4c3)nc2)CC1
Show InChI InChI=1S/C25H30FN9/c1-4-33-9-11-34(12-10-33)15-18-5-7-21(27-13-18)29-25-28-14-20(26)23(30-25)19-6-8-22-31-32-24(17(2)3)35(22)16-19/h5-8,13-14,16-17H,4,9-12,15H2,1-3H3,(H,27,28,29,30)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419864
PNG
(US10464927, Compound I-12)
Show SMILES Cn1nc2nc(ccc2c1C1CCCC1)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C25H28FN9/c1-34-23(16-4-2-3-5-16)18-7-8-20(30-24(18)33-34)22-19(26)15-29-25(32-22)31-21-9-6-17(14-28-21)35-12-10-27-11-13-35/h6-9,14-16,27H,2-5,10-13H2,1H3,(H,28,29,31,32)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419865
PNG
(US10464927, Compound I-13)
Show SMILES CC(C)n1nc(C(N)=O)c2c(F)c(ccc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C24H25F2N9O/c1-13(2)35-17-5-4-15(20(26)19(17)22(33-35)23(27)36)21-16(25)12-30-24(32-21)31-18-6-3-14(11-29-18)34-9-7-28-8-10-34/h3-6,11-13,28H,7-10H2,1-2H3,(H2,27,36)(H,29,30,31,32)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419866
PNG
(US10464927, Compound I-14)
Show SMILES CN(C)C(=O)c1cc2cc(ccc2n1C1CCCC1)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C29H33FN8O/c1-36(2)28(39)25-16-20-15-19(7-9-24(20)38(25)21-5-3-4-6-21)27-23(30)18-33-29(35-27)34-26-10-8-22(17-32-26)37-13-11-31-12-14-37/h7-10,15-18,21,31H,3-6,11-14H2,1-2H3,(H,32,33,34,35)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419868
PNG
(US10464927, Compound I-16)
Show SMILES CC(C)N1CCN(Cc2ccc(Nc3nccc(n3)-c3ccc4n(C)c(C)c(c4c3)C(F)(F)F)nc2)CC1
Show InChI InChI=1S/C28H32F3N7/c1-18(2)38-13-11-37(12-14-38)17-20-5-8-25(33-16-20)35-27-32-10-9-23(34-27)21-6-7-24-22(15-21)26(28(29,30)31)19(3)36(24)4/h5-10,15-16,18H,11-14,17H2,1-4H3,(H,32,33,34,35)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419869
PNG
(US10464927, Compound I-17)
Show SMILES CC(C)c1c(C#N)n(C2CC2)c2ccc(cc12)-c1nc(Nc2ccc(CN3CCN(CC3)C3CC3)cn2)ncc1F
Show InChI InChI=1S/C32H35FN8/c1-20(2)30-25-15-22(4-9-27(25)41(24-7-8-24)28(30)16-34)31-26(33)18-36-32(38-31)37-29-10-3-21(17-35-29)19-39-11-13-40(14-12-39)23-5-6-23/h3-4,9-10,15,17-18,20,23-24H,5-8,11-14,19H2,1-2H3,(H,35,36,37,38)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419870
PNG
(US10464927, Compound I-18)
Show SMILES Fc1cnc(Nc2ccc(CN3CCN(CC3)C3CCCCCC3)cn2)nc1-c1ccc2n(cc(C3CC3)c2c1)C1CCC1
Show InChI InChI=1S/C36H44FN7/c37-32-22-39-36(41-35(32)27-13-14-33-30(20-27)31(26-11-12-26)24-44(33)29-8-5-9-29)40-34-15-10-25(21-38-34)23-42-16-18-43(19-17-42)28-6-3-1-2-4-7-28/h10,13-15,20-22,24,26,28-29H,1-9,11-12,16-19,23H2,(H,38,39,40,41)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419875
PNG
(US10464927, Compound I-23)
Show SMILES CC(C)n1c(cc2cc(ccc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F)C(C)=O
Show InChI InChI=1S/C26H28FN7O/c1-16(2)34-22-6-4-18(12-19(22)13-23(34)17(3)35)25-21(27)15-30-26(32-25)31-24-7-5-20(14-29-24)33-10-8-28-9-11-33/h4-7,12-16,28H,8-11H2,1-3H3,(H,29,30,31,32)
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n/an/a<20n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419881
PNG
(US10464927, Compound I-29)
Show SMILES CC(=O)c1n(nc2nc(ccc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F)C1CC1
Show InChI InChI=1S/C24H24FN9O/c1-14(35)22-17-5-6-19(29-23(17)32-34(22)15-2-3-15)21-18(25)13-28-24(31-21)30-20-7-4-16(12-27-20)33-10-8-26-9-11-33/h4-7,12-13,15,26H,2-3,8-11H2,1H3,(H,27,28,30,31)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419893
PNG
(US10464927, Compound I-41)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ncnc4n(C5CC5)c(cc34)C(C)=O)nc2)CC1
Show InChI InChI=1S/C27H30FN9O/c1-3-35-8-10-36(11-9-35)15-18-4-7-23(29-13-18)33-27-30-14-21(28)25(34-27)24-20-12-22(17(2)38)37(19-5-6-19)26(20)32-16-31-24/h4,7,12-14,16,19H,3,5-6,8-11,15H2,1-2H3,(H,29,30,33,34)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419860
PNG
(US10464927, Compound I-8)
Show SMILES CC(C)n1c(C)nc2cnc(nc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C22H25FN10/c1-13(2)33-14(3)28-17-12-26-20(31-21(17)33)19-16(23)11-27-22(30-19)29-18-5-4-15(10-25-18)32-8-6-24-7-9-32/h4-5,10-13,24H,6-9H2,1-3H3,(H,25,27,29,30)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419854
PNG
(US10464927, Compound I-2)
Show SMILES CC(C)n1ccc2cc(ccc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C24H26FN7/c1-16(2)32-10-7-17-13-18(3-5-21(17)32)23-20(25)15-28-24(30-23)29-22-6-4-19(14-27-22)31-11-8-26-9-12-31/h3-7,10,13-16,26H,8-9,11-12H2,1-2H3,(H,27,28,29,30)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419868
PNG
(US10464927, Compound I-16)
Show SMILES CC(C)N1CCN(Cc2ccc(Nc3nccc(n3)-c3ccc4n(C)c(C)c(c4c3)C(F)(F)F)nc2)CC1
Show InChI InChI=1S/C28H32F3N7/c1-18(2)38-13-11-37(12-14-38)17-20-5-8-25(33-16-20)35-27-32-10-9-23(34-27)21-6-7-24-22(15-21)26(28(29,30)31)19(3)36(24)4/h5-10,15-16,18H,11-14,17H2,1-4H3,(H,32,33,34,35)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419874
PNG
(US10464927, Compound I-22)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4n(C5CCCC5)c(cc4c3)C(=O)N(C)C)nc2)CC1
Show InChI InChI=1S/C32H39FN8O/c1-4-39-13-15-40(16-14-39)21-22-9-12-29(34-19-22)36-32-35-20-26(33)30(37-32)23-10-11-27-24(17-23)18-28(31(42)38(2)3)41(27)25-7-5-6-8-25/h9-12,17-20,25H,4-8,13-16,21H2,1-3H3,(H,34,35,36,37)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419876
PNG
(US10464927, Compound I-24)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4n(C(C)C)c(cc4c3)C(C)=O)nc2)CC1
Show InChI InChI=1S/C29H34FN7O/c1-5-35-10-12-36(13-11-35)18-21-6-9-27(31-16-21)33-29-32-17-24(30)28(34-29)22-7-8-25-23(14-22)15-26(20(4)38)37(25)19(2)3/h6-9,14-17,19H,5,10-13,18H2,1-4H3,(H,31,32,33,34)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419891
PNG
(US10464927, Compound I-39)
Show SMILES CCC(CC)n1c(nc2cnc(nc12)-c1nc(Nc2ccc(CN3CCN(C)CC3)cn2)ncc1F)C(C)C
Show InChI InChI=1S/C28H37FN10/c1-6-20(7-2)39-26(18(3)4)33-22-16-31-25(36-27(22)39)24-21(29)15-32-28(35-24)34-23-9-8-19(14-30-23)17-38-12-10-37(5)11-13-38/h8-9,14-16,18,20H,6-7,10-13,17H2,1-5H3,(H,30,32,34,35)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419892
PNG
(US10464927, Compound I-40)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ncc4nc(C(=O)N(C)C)n(C)c4n3)nc2)CC1
Show InChI InChI=1S/C25H30FN11O/c1-5-36-8-10-37(11-9-36)15-16-6-7-19(27-12-16)31-25-29-13-17(26)20(32-25)21-28-14-18-22(33-21)35(4)23(30-18)24(38)34(2)3/h6-7,12-14H,5,8-11,15H2,1-4H3,(H,27,29,31,32)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419895
PNG
(US10464927, Compound I-43)
Show SMILES CN(C)C(=O)c1nn(C2CCCC2)c2ccc(cc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C28H32FN9O/c1-36(2)27(39)26-21-15-18(7-9-23(21)38(35-26)19-5-3-4-6-19)25-22(29)17-32-28(34-25)33-24-10-8-20(16-31-24)37-13-11-30-12-14-37/h7-10,15-17,19,30H,3-6,11-14H2,1-2H3,(H,31,32,33,34)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419853
PNG
(US10464927, Compound I-1)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4n(ccc4c3)C(C)C)nc2)CC1
Show InChI InChI=1S/C27H32FN7/c1-4-33-11-13-34(14-12-33)18-20-5-8-25(29-16-20)31-27-30-17-23(28)26(32-27)22-6-7-24-21(15-22)9-10-35(24)19(2)3/h5-10,15-17,19H,4,11-14,18H2,1-3H3,(H,29,30,31,32)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419864
PNG
(US10464927, Compound I-12)
Show SMILES Cn1nc2nc(ccc2c1C1CCCC1)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C25H28FN9/c1-34-23(16-4-2-3-5-16)18-7-8-20(30-24(18)33-34)22-19(26)15-29-25(32-22)31-21-9-6-17(14-28-21)35-12-10-27-11-13-35/h6-9,14-16,27H,2-5,10-13H2,1H3,(H,28,29,31,32)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419858
PNG
(US10464927, Compound I-6)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4nnc(C(C)C)n4c3)nc2)CC1
Show InChI InChI=1S/C25H30FN9/c1-4-33-9-11-34(12-10-33)15-18-5-7-21(27-13-18)29-25-28-14-20(26)23(30-25)19-6-8-22-31-32-24(17(2)3)35(22)16-19/h5-8,13-14,16-17H,4,9-12,15H2,1-3H3,(H,27,28,29,30)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419897
PNG
(US10464927, Compound I-45)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4n(nc(C)c4c3F)C3CCCC3)nc2)CC1
Show InChI InChI=1S/C29H34F2N8/c1-3-37-12-14-38(15-13-37)18-20-8-11-25(32-16-20)34-29-33-17-23(30)28(35-29)22-9-10-24-26(27(22)31)19(2)36-39(24)21-6-4-5-7-21/h8-11,16-17,21H,3-7,12-15,18H2,1-2H3,(H,32,33,34,35)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419861
PNG
(US10464927, Compound I-9)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ncc4nc(C)n(C(C)C)c4n3)nc2)CC1
Show InChI InChI=1S/C25H31FN10/c1-5-34-8-10-35(11-9-34)15-18-6-7-21(27-12-18)31-25-29-13-19(26)22(32-25)23-28-14-20-24(33-23)36(16(2)3)17(4)30-20/h6-7,12-14,16H,5,8-11,15H2,1-4H3,(H,27,29,31,32)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419865
PNG
(US10464927, Compound I-13)
Show SMILES CC(C)n1nc(C(N)=O)c2c(F)c(ccc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C24H25F2N9O/c1-13(2)35-17-5-4-15(20(26)19(17)22(33-35)23(27)36)21-16(25)12-30-24(32-21)31-18-6-3-14(11-29-18)34-9-7-28-8-10-34/h3-6,11-13,28H,7-10H2,1-2H3,(H2,27,36)(H,29,30,31,32)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419867
PNG
(US10464927, Compound I-15)
Show SMILES CCC(CC)n1c(cc2cc(ccc12)-c1nc(Nc2ccc(CN3CCN(C)CC3)cn2)ncc1Cl)C(C)=O
Show InChI InChI=1S/C30H36ClN7O/c1-5-24(6-2)38-26-9-8-22(15-23(26)16-27(38)20(3)39)29-25(31)18-33-30(35-29)34-28-10-7-21(17-32-28)19-37-13-11-36(4)12-14-37/h7-10,15-18,24H,5-6,11-14,19H2,1-4H3,(H,32,33,34,35)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419882
PNG
(US10464927, Compound I-30)
Show SMILES CC(C)c1n(C)nc2c(Cl)c(ccc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C24H26ClFN8/c1-14(2)23-17-6-5-16(20(25)22(17)32-33(23)3)21-18(26)13-29-24(31-21)30-19-7-4-15(12-28-19)34-10-8-27-9-11-34/h4-7,12-14,27H,8-11H2,1-3H3,(H,28,29,30,31)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419860
PNG
(US10464927, Compound I-8)
Show SMILES CC(C)n1c(C)nc2cnc(nc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C22H25FN10/c1-13(2)33-14(3)28-17-12-26-20(31-21(17)33)19-16(23)11-27-22(30-19)29-18-5-4-15(10-25-18)32-8-6-24-7-9-32/h4-5,10-13,24H,6-9H2,1-3H3,(H,25,27,29,30)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419869
PNG
(US10464927, Compound I-17)
Show SMILES CC(C)c1c(C#N)n(C2CC2)c2ccc(cc12)-c1nc(Nc2ccc(CN3CCN(CC3)C3CC3)cn2)ncc1F
Show InChI InChI=1S/C32H35FN8/c1-20(2)30-25-15-22(4-9-27(25)41(24-7-8-24)28(30)16-34)31-26(33)18-36-32(38-31)37-29-10-3-21(17-35-29)19-39-11-13-40(14-12-39)23-5-6-23/h3-4,9-10,15,17-18,20,23-24H,5-8,11-14,19H2,1-2H3,(H,35,36,37,38)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419889
PNG
(US10464927, Compound I-37)
Show SMILES CN(C)C(=O)c1nc2cnc(nc2n1C1CCCC1)-c1nc(Nc2ccc(cn2)N2CCN(C)CC2)ncc1F
Show InChI InChI=1S/C27H32FN11O/c1-36(2)26(40)25-32-20-16-30-23(35-24(20)39(25)17-6-4-5-7-17)22-19(28)15-31-27(34-22)33-21-9-8-18(14-29-21)38-12-10-37(3)11-13-38/h8-9,14-17H,4-7,10-13H2,1-3H3,(H,29,31,33,34)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419887
PNG
(US10464927, Compound I-35)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4nnc(C(C)=O)n4c3)nc2)CC1
Show InChI InChI=1S/C24H26FN9O/c1-3-32-8-10-33(11-9-32)14-17-4-6-20(26-12-17)28-24-27-13-19(25)22(29-24)18-5-7-21-30-31-23(16(2)35)34(21)15-18/h4-7,12-13,15H,3,8-11,14H2,1-2H3,(H,26,27,28,29)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419861
PNG
(US10464927, Compound I-9)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ncc4nc(C)n(C(C)C)c4n3)nc2)CC1
Show InChI InChI=1S/C25H31FN10/c1-5-34-8-10-35(11-9-34)15-18-6-7-21(27-12-18)31-25-29-13-19(26)22(32-25)23-28-14-20-24(33-23)36(16(2)3)17(4)30-20/h6-7,12-14,16H,5,8-11,15H2,1-4H3,(H,27,29,31,32)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419878
PNG
(US10464927, Compound I-26)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4n(C(C)C)c(cc4n3)C(=O)N(C)C)nc2)CC1
Show InChI InChI=1S/C29H36FN9O/c1-6-37-11-13-38(14-12-37)18-20-7-10-26(31-16-20)34-29-32-17-21(30)27(35-29)22-8-9-24-23(33-22)15-25(28(40)36(4)5)39(24)19(2)3/h7-10,15-17,19H,6,11-14,18H2,1-5H3,(H,31,32,34,35)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419884
PNG
(US10464927, Compound I-32)
Show SMILES CC(=O)c1nc(C2CC2)n2cc(cc(F)c12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C25H24F2N8O/c1-14(36)21-23-18(26)10-16(13-35(23)24(32-21)15-2-3-15)22-19(27)12-30-25(33-22)31-20-5-4-17(11-29-20)34-8-6-28-7-9-34/h4-5,10-13,15,28H,2-3,6-9H2,1H3,(H,29,30,31,33)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419898
PNG
(US10464927, Compound I-46)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4n(nc(c4n3)C(F)(F)F)C3CCCC3)nc2)CC1
Show InChI InChI=1S/C28H31F4N9/c1-2-39-11-13-40(14-12-39)17-18-7-10-23(33-15-18)36-27-34-16-20(29)24(37-27)21-8-9-22-25(35-21)26(28(30,31)32)38-41(22)19-5-3-4-6-19/h7-10,15-16,19H,2-6,11-14,17H2,1H3,(H,33,34,36,37)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419887
PNG
(US10464927, Compound I-35)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4nnc(C(C)=O)n4c3)nc2)CC1
Show InChI InChI=1S/C24H26FN9O/c1-3-32-8-10-33(11-9-32)14-17-4-6-20(26-12-17)28-24-27-13-19(25)22(29-24)18-5-7-21-30-31-23(16(2)35)34(21)15-18/h4-7,12-13,15H,3,8-11,14H2,1-2H3,(H,26,27,28,29)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419873
PNG
(US10464927, Compound I-21)
Show SMILES CC(C)n1c(cc2cc(ccc12)-c1nc(Nc2ccc(cn2)N2CCN(CC2)C2CCC2)ncc1F)C1CCCC1
Show InChI InChI=1S/C33H40FN7/c1-22(2)41-29-12-10-24(18-25(29)19-30(41)23-6-3-4-7-23)32-28(34)21-36-33(38-32)37-31-13-11-27(20-35-31)40-16-14-39(15-17-40)26-8-5-9-26/h10-13,18-23,26H,3-9,14-17H2,1-2H3,(H,35,36,37,38)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419880
PNG
(US10464927, Compound I-28)
Show SMILES CC(C)n1c(cc2c(F)c(ccc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F)C(=O)N(C)C
Show InChI InChI=1S/C27H30F2N8O/c1-16(2)37-21-7-6-18(24(29)19(21)13-22(37)26(38)35(3)4)25-20(28)15-32-27(34-25)33-23-8-5-17(14-31-23)36-11-9-30-10-12-36/h5-8,13-16,30H,9-12H2,1-4H3,(H,31,32,33,34)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419898
PNG
(US10464927, Compound I-46)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4n(nc(c4n3)C(F)(F)F)C3CCCC3)nc2)CC1
Show InChI InChI=1S/C28H31F4N9/c1-2-39-11-13-40(14-12-39)17-18-7-10-23(33-15-18)36-27-34-16-20(29)24(37-27)21-8-9-22-25(35-21)26(28(30,31)32)38-41(22)19-5-3-4-6-19/h7-10,15-16,19H,2-6,11-14,17H2,1H3,(H,33,34,36,37)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419862
PNG
(US10464927, Compound I-10)
Show SMILES CC(C)n1c(C(=O)N(C)C)c(F)c2c(ncnc12)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
Show InChI InChI=1S/C25H28F2N10O/c1-14(2)37-22(24(38)35(3)4)19(27)18-21(31-13-32-23(18)37)20-16(26)12-30-25(34-20)33-17-6-5-15(11-29-17)36-9-7-28-8-10-36/h5-6,11-14,28H,7-10H2,1-4H3,(H,29,30,33,34)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419856
PNG
(US10464927, Compound I-4)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4n(cc(C(C)=O)c4c3)C3CCCC3)nc2)CC1
Show InChI InChI=1S/C31H36FN7O/c1-3-37-12-14-38(15-13-37)19-22-8-11-29(33-17-22)35-31-34-18-27(32)30(36-31)23-9-10-28-25(16-23)26(21(2)40)20-39(28)24-6-4-5-7-24/h8-11,16-18,20,24H,3-7,12-15,19H2,1-2H3,(H,33,34,35,36)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419894
PNG
(US10464927, Compound I-42)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ncnc4n(C)cc(C#N)c34)nc2)CC1
Show InChI InChI=1S/C24H25FN10/c1-3-34-6-8-35(9-7-34)13-16-4-5-19(27-11-16)31-24-28-12-18(25)21(32-24)22-20-17(10-26)14-33(2)23(20)30-15-29-22/h4-5,11-12,14-15H,3,6-9,13H2,1-2H3,(H,27,28,31,32)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419897
PNG
(US10464927, Compound I-45)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4n(nc(C)c4c3F)C3CCCC3)nc2)CC1
Show InChI InChI=1S/C29H34F2N8/c1-3-37-12-14-38(15-13-37)18-20-8-11-25(32-16-20)34-29-33-17-23(30)28(35-29)22-9-10-24-26(27(22)31)19(2)36-39(24)21-6-4-5-7-21/h8-11,16-17,21H,3-7,12-15,18H2,1-2H3,(H,32,33,34,35)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419899
PNG
(US10464927, Compound I-47)
Show SMILES CC(C)n1c(C)nc2cnc(nc12)-c1nc(Nc2ccc(cn2)N2CCN(C)CC2)ncc1F
Show InChI InChI=1S/C23H27FN10/c1-14(2)34-15(3)28-18-13-26-21(31-22(18)34)20-17(24)12-27-23(30-20)29-19-6-5-16(11-25-19)33-9-7-32(4)8-10-33/h5-6,11-14H,7-10H2,1-4H3,(H,25,27,29,30)
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Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 4


(Homo sapiens (Human))
BDBM419867
PNG
(US10464927, Compound I-15)
Show SMILES CCC(CC)n1c(cc2cc(ccc12)-c1nc(Nc2ccc(CN3CCN(C)CC3)cn2)ncc1Cl)C(C)=O
Show InChI InChI=1S/C30H36ClN7O/c1-5-24(6-2)38-26-9-8-22(15-23(26)16-27(38)20(3)39)29-25(31)18-33-30(35-29)34-28-10-7-21(17-32-28)19-37-13-11-36(4)12-14-37/h7-10,15-18,24H,5-6,11-14,19H2,1-4H3,(H,32,33,34,35)
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n/an/a 300n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK4: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM DT...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419900
PNG
(US10464927, Compound I-48)
Show SMILES CCN1CCN(CC1)c1ccc(Nc2ncc(F)c(n2)-c2ncc3nc(C)n(C(C)C)c3n2)nc1
Show InChI InChI=1S/C24H29FN10/c1-5-33-8-10-34(11-9-33)17-6-7-20(26-12-17)30-24-28-13-18(25)21(31-24)22-27-14-19-23(32-22)35(15(2)3)16(4)29-19/h6-7,12-15H,5,8-11H2,1-4H3,(H,26,28,30,31)
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n/an/a 300n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419863
PNG
(US10464927, Compound I-11)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ncnc4n(C5CCCC5)c(C)cc34)nc2)CC1
Show InChI InChI=1S/C28H34FN9/c1-3-36-10-12-37(13-11-36)17-20-8-9-24(30-15-20)34-28-31-16-23(29)26(35-28)25-22-14-19(2)38(21-6-4-5-7-21)27(22)33-18-32-25/h8-9,14-16,18,21H,3-7,10-13,17H2,1-2H3,(H,30,31,34,35)
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n/an/a 300n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419871
PNG
(US10464927, Compound I-19)
Show SMILES Fc1cnc(Nc2ccc(CN3CCN(CC3)C3CCCCC3)cn2)nc1-c1ccc2n(cc(C3CCC3)c2c1)C1CCCCC1
Show InChI InChI=1S/C38H48FN7/c39-34-24-41-38(42-36-17-14-27(23-40-36)25-44-18-20-45(21-19-44)30-10-3-1-4-11-30)43-37(34)29-15-16-35-32(22-29)33(28-8-7-9-28)26-46(35)31-12-5-2-6-13-31/h14-17,22-24,26,28,30-31H,1-13,18-21,25H2,(H,40,41,42,43)
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n/an/a>500n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

More data for this
Ligand-Target Pair
Cyclin-dependent kinase 6


(Homo sapiens (Human))
BDBM419896
PNG
(US10464927, Compound I-44)
Show SMILES CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3ccc4n(nc(C(C)=O)c4c3)C(C)C)nc2)CC1
Show InChI InChI=1S/C28H33FN8O/c1-5-35-10-12-36(13-11-35)17-20-6-9-25(30-15-20)32-28-31-16-23(29)27(33-28)21-7-8-24-22(14-21)26(19(4)38)34-37(24)18(2)3/h6-9,14-16,18H,5,10-13,17H2,1-4H3,(H,30,31,32,33)
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n/an/a>500n/an/an/an/an/an/a



Shanghai Xunhe Pharmaceutical Technology Co. Ltd.

US Patent


Assay Description
CDK6: The test compound was dissolved in DMSO and diluted with a kinase buffer solution (20 mM HEPES-pH 7.5, 0.01% Triton X-100, 10 mM MgCl2, 2 mM D...


US Patent US10464927 (2019)

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