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Patent code US9822103

Compile Data Set for Download or QSAR
Found 94 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
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359818
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC4(CCCC4)Oc3c(c2)-c2ccc(nc2)N2CCNCC2)c(=O)[nH]1
Show InChI InChI=1S/C30H35N5O3/c1-19-13-20(2)34-29(37)25(19)18-33-28(36)22-14-23-16-30(7-3-4-8-30)38-27(23)24(15-22)21-5-6-26(32-17-21)35-11-9-31-10-12-35/h5-6,13-15,17,31H,3-4,7-12,16,18H2,1-2H3,(H,33,36)(H,34,37)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359741
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(c2)-c2ccc(nc2)N2CCOCC2)c(=O)[nH]1
Show InChI InChI=1S/C28H32N4O4/c1-17-11-18(2)31-27(34)23(17)16-30-26(33)20-12-21-14-28(3,4)36-25(21)22(13-20)19-5-6-24(29-15-19)32-7-9-35-10-8-32/h5-6,11-13,15H,7-10,14,16H2,1-4H3,(H,30,33)(H,31,34)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359798
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(Oc3c(c2)-c2ccc(nc2)N2CCNCC2)C=C)c(=O)[nH]1
Show InChI InChI=1S/C29H33N5O3/c1-5-29(4)15-22-13-21(27(35)32-17-24-18(2)12-19(3)33-28(24)36)14-23(26(22)37-29)20-6-7-25(31-16-20)34-10-8-30-9-11-34/h5-7,12-14,16,30H,1,8-11,15,17H2,2-4H3,(H,32,35)(H,33,36)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359801
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES CCC1(C)Cc2cc(cc(c2O1)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C29H35N5O3/c1-5-29(4)15-22-13-21(27(35)32-17-24-18(2)12-19(3)33-28(24)36)14-23(26(22)37-29)20-6-7-25(31-16-20)34-10-8-30-9-11-34/h6-7,12-14,16,30H,5,8-11,15,17H2,1-4H3,(H,32,35)(H,33,36)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359750
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(c2)-c2cnc(nc2)N2CCNCC2)c(=O)[nH]1
Show InChI InChI=1S/C27H32N6O3/c1-16-9-17(2)32-25(35)22(16)15-29-24(34)18-10-19-12-27(3,4)36-23(19)21(11-18)20-13-30-26(31-14-20)33-7-5-28-6-8-33/h9-11,13-14,28H,5-8,12,15H2,1-4H3,(H,29,34)(H,32,35)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359746
PNG
(US9822103, Example 17 | t-Butyl 4-(5-(5-(((4,6-dim...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(c2)-c2cnc(nc2)N2CCN(CC2)C(=O)OC(C)(C)C)c(=O)[nH]1
Show InChI InChI=1S/C32H40N6O5/c1-19-12-20(2)36-28(40)25(19)18-33-27(39)21-13-22-15-32(6,7)42-26(22)24(14-21)23-16-34-29(35-17-23)37-8-10-38(11-9-37)30(41)43-31(3,4)5/h12-14,16-17H,8-11,15,18H2,1-7H3,(H,33,39)(H,36,40)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359837
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES CC(=C)C1(C)Cc2cc(cc(c2O1)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C30H35N5O3/c1-18(2)30(5)15-23-13-22(28(36)33-17-25-19(3)12-20(4)34-29(25)37)14-24(27(23)38-30)21-6-7-26(32-16-21)35-10-8-31-9-11-35/h6-7,12-14,16,31H,1,8-11,15,17H2,2-5H3,(H,33,36)(H,34,37)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359845
PNG
(2-Isopropyl-7-(6-(4-isopropylpiperazin-1-yl)pyridi...)
Show SMILES CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc2CC(C)(Oc2c(c1)-c1ccc(nc1)N1CCN(CC1)C(C)C)C(C)C
Show InChI InChI=1S/C35H47N5O3/c1-8-9-25-16-24(6)38-34(42)30(25)21-37-33(41)27-17-28-19-35(7,22(2)3)43-32(28)29(18-27)26-10-11-31(36-20-26)40-14-12-39(13-15-40)23(4)5/h10-11,16-18,20,22-23H,8-9,12-15,19,21H2,1-7H3,(H,37,41)(H,38,42)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359846
PNG
(2-Methyl-N-((6-methyl-2-oxo-4-propyl-1,2-dihydropy...)
Show SMILES CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc2CC(C)(Oc2c(c1)-c1cnc(nc1)N1CCNCC1)C(C)=C
Show InChI InChI=1S/C31H38N6O3/c1-6-7-21-12-20(4)36-29(39)26(21)18-33-28(38)22-13-23-15-31(5,19(2)3)40-27(23)25(14-22)24-16-34-30(35-17-24)37-10-8-32-9-11-37/h12-14,16-17,32H,2,6-11,15,18H2,1,3-5H3,(H,33,38)(H,36,39)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359839
PNG
(2-Methyl-N-((6-methyl-2-oxo-4-propyl-1,2-dihydropy...)
Show SMILES CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc2CC(C)(Oc2c(c1)-c1ccc(nc1)N1CCNCC1)C(C)=C
Show InChI InChI=1S/C32H39N5O3/c1-6-7-22-14-21(4)36-31(39)27(22)19-35-30(38)24-15-25-17-32(5,20(2)3)40-29(25)26(16-24)23-8-9-28(34-18-23)37-12-10-33-11-13-37/h8-9,14-16,18,33H,2,6-7,10-13,17,19H2,1,3-5H3,(H,35,38)(H,36,39)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359809
PNG
(US9822103, Example 69 | rac-(3aS,8bS)-5-Bromo-N-((...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3[C@@H]4CCC[C@]4(C)Oc3c(Br)c2C)c(=O)[nH]1
Show InChI InChI=1S/C22H25BrN2O3/c1-11-8-12(2)25-21(27)16(11)10-24-20(26)14-9-15-17-6-5-7-22(17,4)28-19(15)18(23)13(14)3/h8-9,17H,5-7,10H2,1-4H3,(H,24,26)(H,25,27)/t17-,22-/m0/s1
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359747
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(c2)-c2ccc(cc2)N2CCNCC2)c(=O)[nH]1
Show InChI InChI=1S/C29H34N4O3/c1-18-13-19(2)32-28(35)25(18)17-31-27(34)21-14-22-16-29(3,4)36-26(22)24(15-21)20-5-7-23(8-6-20)33-11-9-30-10-12-33/h5-8,13-15,30H,9-12,16-17H2,1-4H3,(H,31,34)(H,32,35)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359730
PNG
(7-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(Br)c2)c(=O)[nH]1
Show InChI InChI=1S/C19H21BrN2O3/c1-10-5-11(2)22-18(24)14(10)9-21-17(23)12-6-13-8-19(3,4)25-16(13)15(20)7-12/h5-7H,8-9H2,1-4H3,(H,21,23)(H,22,24)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359756
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc(c3OC(C)(C)Cc3c2C)-c2ccc(nc2)N2CCNCC2)c(=O)[nH]1
Show InChI InChI=1S/C29H35N5O3/c1-17-12-18(2)33-28(36)24(17)16-32-27(35)21-13-22(26-23(19(21)3)14-29(4,5)37-26)20-6-7-25(31-15-20)34-10-8-30-9-11-34/h6-7,12-13,15,30H,8-11,14,16H2,1-5H3,(H,32,35)(H,33,36)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359840
PNG
(2-isopropyl-2-methyl-N-((6-methyl-2-oxo-4-propyl-1...)
Show SMILES CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc2CC(C)(Oc2c(c1)-c1ccc(nc1)N1CCNCC1)C(C)C
Show InChI InChI=1S/C32H41N5O3/c1-6-7-22-14-21(4)36-31(39)27(22)19-35-30(38)24-15-25-17-32(5,20(2)3)40-29(25)26(16-24)23-8-9-28(34-18-23)37-12-10-33-11-13-37/h8-9,14-16,18,20,33H,6-7,10-13,17,19H2,1-5H3,(H,35,38)(H,36,39)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359740
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(c2)-c2ccc(nc2)N2CCNCC2)c(=O)[nH]1
Show InChI InChI=1S/C28H33N5O3/c1-17-11-18(2)32-27(35)23(17)16-31-26(34)20-12-21-14-28(3,4)36-25(21)22(13-20)19-5-6-24(30-15-19)33-9-7-29-8-10-33/h5-6,11-13,15,29H,7-10,14,16H2,1-4H3,(H,31,34)(H,32,35)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359805
PNG
(US9822103, Example 65 | rac-(3aS,8bS)—N-((4,6-Dime...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3[C@@H]4CCC[C@]4(C)Oc3c(c2)-c2ccc(nc2)N2CCNCC2)c(=O)[nH]1
Show InChI InChI=1S/C30H35N5O3/c1-18-13-19(2)34-29(37)24(18)17-33-28(36)21-14-22(27-23(15-21)25-5-4-8-30(25,3)38-27)20-6-7-26(32-16-20)35-11-9-31-10-12-35/h6-7,13-16,25,31H,4-5,8-12,17H2,1-3H3,(H,33,36)(H,34,37)/t25-,30-/m0/s1
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359808
PNG
(US9822103, Example 68 | rac-(3aS,8bS)—N-((4,6-Dime...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3[C@@H]4CCC[C@]4(C)Oc3c(c2)-c2ccc(cc2)N2CCNCC2)c(=O)[nH]1
Show InChI InChI=1S/C31H36N4O3/c1-19-15-20(2)34-30(37)26(19)18-33-29(36)22-16-24(28-25(17-22)27-5-4-10-31(27,3)38-28)21-6-8-23(9-7-21)35-13-11-32-12-14-35/h6-9,15-17,27,32H,4-5,10-14,18H2,1-3H3,(H,33,36)(H,34,37)/t27-,31-/m0/s1
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359736
PNG
(7-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc(Br)c3OC(C)(C)Cc3c2C)c(=O)[nH]1
Show InChI InChI=1S/C20H23BrN2O3/c1-10-6-11(2)23-19(25)15(10)9-22-18(24)13-7-16(21)17-14(12(13)3)8-20(4,5)26-17/h6-7H,8-9H2,1-5H3,(H,22,24)(H,23,25)
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US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359755
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES COc1ccc(cn1)-c1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c(C)c2CC(C)(C)Oc12
Show InChI InChI=1S/C26H29N3O4/c1-14-9-15(2)29-25(31)21(14)13-28-24(30)18-10-19(17-7-8-22(32-6)27-12-17)23-20(16(18)3)11-26(4,5)33-23/h7-10,12H,11,13H2,1-6H3,(H,28,30)(H,29,31)
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US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359806
PNG
(US9822103, Example 66 | rac-(3aS,8bS)—N-((4,6-Dime...)
Show SMILES COc1ccc(cn1)-c1cc(cc2[C@@H]3CCC[C@]3(C)Oc12)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C27H29N3O4/c1-15-10-16(2)30-26(32)21(15)14-29-25(31)18-11-19(17-7-8-23(33-4)28-13-17)24-20(12-18)22-6-5-9-27(22,3)34-24/h7-8,10-13,22H,5-6,9,14H2,1-4H3,(H,29,31)(H,30,32)/t22-,27-/m0/s1
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US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359743
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES COc1ccc(cn1)-c1cc(cc2CC(C)(C)Oc12)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C25H27N3O4/c1-14-8-15(2)28-24(30)20(14)13-27-23(29)17-9-18-11-25(3,4)32-22(18)19(10-17)16-6-7-21(31-5)26-12-16/h6-10,12H,11,13H2,1-5H3,(H,27,29)(H,28,30)
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US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359807
PNG
(US9822103, Example 67 | rac-(3aS,8bS)—N-((4,6-Dime...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3[C@@H]4CCC[C@]4(C)Oc3c(c2)-c2ccc(CN3CCCCC3)cc2)c(=O)[nH]1
Show InChI InChI=1S/C33H39N3O3/c1-21-16-22(2)35-32(38)28(21)19-34-31(37)25-17-26(30-27(18-25)29-8-7-13-33(29,3)39-30)24-11-9-23(10-12-24)20-36-14-5-4-6-15-36/h9-12,16-18,29H,4-8,13-15,19-20H2,1-3H3,(H,34,37)(H,35,38)/t29-,33-/m0/s1
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359834
PNG
(N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES COc1ccc(cn1)-c1cc(cc2CC(C)(Oc12)C(C)=C)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C27H29N3O4/c1-15(2)27(5)12-20-10-19(25(31)29-14-22-16(3)9-17(4)30-26(22)32)11-21(24(20)34-27)18-7-8-23(33-6)28-13-18/h7-11,13H,1,12,14H2,2-6H3,(H,29,31)(H,30,32)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359735
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(C)c2)c(=O)[nH]1
Show InChI InChI=1S/C20H24N2O3/c1-11-6-13(3)22-19(24)16(11)10-21-18(23)14-7-12(2)17-15(8-14)9-20(4,5)25-17/h6-8H,9-10H2,1-5H3,(H,21,23)(H,22,24)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359754
PNG
(7-Bromo-2,2-dimethyl-N-((6-methyl-2-oxo-4-propyl-1...)
Show SMILES CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc2CC(C)(C)Oc2c(Br)c1
Show InChI InChI=1S/C21H25BrN2O3/c1-5-6-13-7-12(2)24-20(26)16(13)11-23-19(25)14-8-15-10-21(3,4)27-18(15)17(22)9-14/h7-9H,5-6,10-11H2,1-4H3,(H,23,25)(H,24,26)
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US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359768
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CCOc3c(c2)-c2ccc(nc2)N2CCNCC2)c(=O)[nH]1
Show InChI InChI=1S/C26H29N5O3/c1-16-11-17(2)30-26(33)22(16)15-29-25(32)20-12-18-5-10-34-24(18)21(13-20)19-3-4-23(28-14-19)31-8-6-27-7-9-31/h3-4,11-14,27H,5-10,15H2,1-2H3,(H,29,32)(H,30,33)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359771
PNG
((2S,3R)-7-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydro...)
Show SMILES C[C@@H]1Oc2c(cc(cc2Br)C(=O)NCc2c(C)cc(C)[nH]c2=O)[C@H]1C
Show InChI InChI=1S/C19H21BrN2O3/c1-9-5-10(2)22-19(24)15(9)8-21-18(23)13-6-14-11(3)12(4)25-17(14)16(20)7-13/h5-7,11-12H,8H2,1-4H3,(H,21,23)(H,22,24)/t11-,12-/m0/s1
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359810
PNG
(7-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC4(CCCC4)Oc3c(Br)c2)c(=O)[nH]1
Show InChI InChI=1S/C21H23BrN2O3/c1-12-7-13(2)24-20(26)16(12)11-23-19(25)14-8-15-10-21(5-3-4-6-21)27-18(15)17(22)9-14/h7-9H,3-6,10-11H2,1-2H3,(H,23,25)(H,24,26)
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Bristol-Myers Squibb Company

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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359811
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES COc1ccc(cn1)-c1cc(cc2CC3(CCCC3)Oc12)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C27H29N3O4/c1-16-10-17(2)30-26(32)22(16)15-29-25(31)19-11-20-13-27(8-4-5-9-27)34-24(20)21(12-19)18-6-7-23(33-3)28-14-18/h6-7,10-12,14H,4-5,8-9,13,15H2,1-3H3,(H,29,31)(H,30,32)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359820
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC4(CCCC4)Oc3c(c2)-c2ccc(CN3CCCCC3)cc2)c(=O)[nH]1
Show InChI InChI=1S/C33H39N3O3/c1-22-16-23(2)35-32(38)29(22)20-34-31(37)26-17-27-19-33(12-4-5-13-33)39-30(27)28(18-26)25-10-8-24(9-11-25)21-36-14-6-3-7-15-36/h8-11,16-18H,3-7,12-15,19-21H2,1-2H3,(H,34,37)(H,35,38)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359826
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3c(OCC33CCCC3)c(c2)-c2ccc(CN3CCCCC3)cc2)c(=O)[nH]1
Show InChI InChI=1S/C33H39N3O3/c1-22-16-23(2)35-32(38)28(22)19-34-31(37)26-17-27(30-29(18-26)33(21-39-30)12-4-5-13-33)25-10-8-24(9-11-25)20-36-14-6-3-7-15-36/h8-11,16-18H,3-7,12-15,19-21H2,1-2H3,(H,34,37)(H,35,38)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359836
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES COc1ccc(cn1)-c1cc(cc2CC(C)(Oc12)C(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C27H31N3O4/c1-15(2)27(5)12-20-10-19(25(31)29-14-22-16(3)9-17(4)30-26(22)32)11-21(24(20)34-27)18-7-8-23(33-6)28-13-18/h7-11,13,15H,12,14H2,1-6H3,(H,29,31)(H,30,32)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359843
PNG
(8-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-...)
Show SMILES CCC1COc2cc(cc(Br)c2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C19H21BrN2O4/c1-4-13-9-25-16-7-12(6-15(20)17(16)26-13)18(23)21-8-14-10(2)5-11(3)22-19(14)24/h5-7,13H,4,8-9H2,1-3H3,(H,21,23)(H,22,24)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359733
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(F)c2)c(=O)[nH]1
Show InChI InChI=1S/C19H21FN2O3/c1-10-5-11(2)22-18(24)14(10)9-21-17(23)12-6-13-8-19(3,4)25-16(13)15(20)7-12/h5-7H,8-9H2,1-4H3,(H,21,23)(H,22,24)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359738
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc(C)c3OC(C)(C)Cc3c2C)c(=O)[nH]1
Show InChI InChI=1S/C21H26N2O3/c1-11-7-13(3)23-20(25)17(11)10-22-19(24)15-8-12(2)18-16(14(15)4)9-21(5,6)26-18/h7-8H,9-10H2,1-6H3,(H,22,24)(H,23,25)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359739
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(c2)-c2ccc(CN3CCOCC3)cc2)c(=O)[nH]1
Show InChI InChI=1S/C30H35N3O4/c1-19-13-20(2)32-29(35)26(19)17-31-28(34)23-14-24-16-30(3,4)37-27(24)25(15-23)22-7-5-21(6-8-22)18-33-9-11-36-12-10-33/h5-8,13-15H,9-12,16-18H2,1-4H3,(H,31,34)(H,32,35)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359742
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(c2)-c2cnc3ccccc3c2)c(=O)[nH]1
Show InChI InChI=1S/C28H27N3O3/c1-16-9-17(2)31-27(33)23(16)15-30-26(32)19-11-20-13-28(3,4)34-25(20)22(12-19)21-10-18-7-5-6-8-24(18)29-14-21/h5-12,14H,13,15H2,1-4H3,(H,30,32)(H,31,33)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359758
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES CC1COc2c1cc(cc2-c1ccc(CN2CCOCC2)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C29H33N3O4/c1-18-12-20(3)31-29(34)26(18)15-30-28(33)23-13-24-19(2)17-36-27(24)25(14-23)22-6-4-21(5-7-22)16-32-8-10-35-11-9-32/h4-7,12-14,19H,8-11,15-17H2,1-3H3,(H,30,33)(H,31,34)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359763
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES CC1Cc2cc(cc(c2O1)-c1ccc(nc1)N1CCOCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C27H30N4O4/c1-16-10-17(2)30-27(33)23(16)15-29-26(32)21-12-20-11-18(3)35-25(20)22(13-21)19-4-5-24(28-14-19)31-6-8-34-9-7-31/h4-5,10,12-14,18H,6-9,11,15H2,1-3H3,(H,29,32)(H,30,33)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359764
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES CC1Cc2cc(cc(c2O1)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C27H31N5O3/c1-16-10-17(2)31-27(34)23(16)15-30-26(33)21-12-20-11-18(3)35-25(20)22(13-21)19-4-5-24(29-14-19)32-8-6-28-7-9-32/h4-5,10,12-14,18,28H,6-9,11,15H2,1-3H3,(H,30,33)(H,31,34)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359765
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES CC1Cc2cc(cc(c2O1)-c1ccc(CN2CCOCC2)cc1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C29H33N3O4/c1-18-12-19(2)31-29(34)26(18)16-30-28(33)24-14-23-13-20(3)36-27(23)25(15-24)22-6-4-21(5-7-22)17-32-8-10-35-11-9-32/h4-7,12,14-15,20H,8-11,13,16-17H2,1-3H3,(H,30,33)(H,31,34)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359793
PNG
(N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES COc1ccc(cn1)-c1cc(cc2CCC(C)COc12)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C26H29N3O4/c1-15-5-6-18-10-20(25(30)28-13-22-16(2)9-17(3)29-26(22)31)11-21(24(18)33-14-15)19-7-8-23(32-4)27-12-19/h7-12,15H,5-6,13-14H2,1-4H3,(H,28,30)(H,29,31)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359822
PNG
(7-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3c(OCC33CCCC3)c(Br)c2)c(=O)[nH]1
Show InChI InChI=1S/C21H23BrN2O3/c1-12-7-13(2)24-20(26)15(12)10-23-19(25)14-8-16-18(17(22)9-14)27-11-21(16)5-3-4-6-21/h7-9H,3-6,10-11H2,1-2H3,(H,23,25)(H,24,26)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359838
PNG
(9-Bromo-3,4-dimethyl-N-((6-methyl-2-oxo-4-propyl-1...)
Show SMILES CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Br)c2OCC(C)=C(C)Cc2c1
Show InChI InChI=1S/C23H27BrN2O3/c1-5-6-16-8-15(4)26-23(28)19(16)11-25-22(27)18-9-17-7-13(2)14(3)12-29-21(17)20(24)10-18/h8-10H,5-7,11-12H2,1-4H3,(H,25,27)(H,26,28)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359749
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(c2)-c2ccc(CN3CCCCC3)cc2)c(=O)[nH]1
Show InChI InChI=1S/C31H37N3O3/c1-20-14-21(2)33-30(36)27(20)18-32-29(35)24-15-25-17-31(3,4)37-28(25)26(16-24)23-10-8-22(9-11-23)19-34-12-6-5-7-13-34/h8-11,14-16H,5-7,12-13,17-19H2,1-4H3,(H,32,35)(H,33,36)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359751
PNG
(7-Benzyl-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(Cc3ccccc3)c2)c(=O)[nH]1
Show InChI InChI=1S/C26H28N2O3/c1-16-10-17(2)28-25(30)22(16)15-27-24(29)20-12-19(11-18-8-6-5-7-9-18)23-21(13-20)14-26(3,4)31-23/h5-10,12-13H,11,14-15H2,1-4H3,(H,27,29)(H,28,30)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359730
PNG
(7-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(Br)c2)c(=O)[nH]1
Show InChI InChI=1S/C19H21BrN2O3/c1-10-5-11(2)22-18(24)14(10)9-21-17(23)12-6-13-8-19(3,4)25-16(13)15(20)7-12/h5-7H,8-9H2,1-4H3,(H,21,23)(H,22,24)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359753
PNG
(7-Chloro-2,2-dimethyl-N-((6-methyl-2-oxo-4-propyl-...)
Show SMILES CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc2CC(C)(C)Oc2c(Cl)c1
Show InChI InChI=1S/C21H25ClN2O3/c1-5-6-13-7-12(2)24-20(26)16(13)11-23-19(25)14-8-15-10-21(3,4)27-18(15)17(22)9-14/h7-9H,5-6,10-11H2,1-4H3,(H,23,25)(H,24,26)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359759
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES CC1COc2c1cc(cc2-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C27H31N5O3/c1-16-10-18(3)31-27(34)23(16)14-30-26(33)20-11-21-17(2)15-35-25(21)22(12-20)19-4-5-24(29-13-19)32-8-6-28-7-9-32/h4-5,10-13,17,28H,6-9,14-15H2,1-3H3,(H,30,33)(H,31,34)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359761
PNG
(7-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-...)
Show SMILES CC1Cc2cc(cc(Br)c2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C18H19BrN2O3/c1-9-4-10(2)21-18(23)14(9)8-20-17(22)13-6-12-5-11(3)24-16(12)15(19)7-13/h4,6-7,11H,5,8H2,1-3H3,(H,20,22)(H,21,23)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359767
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CCOc3c(c2)-c2ccc(nc2)N2CCOCC2)c(=O)[nH]1
Show InChI InChI=1S/C26H28N4O4/c1-16-11-17(2)29-26(32)22(16)15-28-25(31)20-12-18-5-8-34-24(18)21(13-20)19-3-4-23(27-14-19)30-6-9-33-10-7-30/h3-4,11-14H,5-10,15H2,1-2H3,(H,28,31)(H,29,32)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359797
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(Oc3c(c2)-c2ccc(CN3CCOCC3)cc2)C=C)c(=O)[nH]1
Show InChI InChI=1S/C31H35N3O4/c1-5-31(4)17-25-15-24(29(35)32-18-27-20(2)14-21(3)33-30(27)36)16-26(28(25)38-31)23-8-6-22(7-9-23)19-34-10-12-37-13-11-34/h5-9,14-16H,1,10-13,17-19H2,2-4H3,(H,32,35)(H,33,36)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359803
PNG
(US9822103, Example 64 | rac-(3aS,8bS)-5-Bromo-N-((...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3[C@@H]4CCC[C@]4(C)Oc3c(Br)c2)c(=O)[nH]1
Show InChI InChI=1S/C21H23BrN2O3/c1-11-7-12(2)24-20(26)15(11)10-23-19(25)13-8-14-16-5-4-6-21(16,3)27-18(14)17(22)9-13/h7-9,16H,4-6,10H2,1-3H3,(H,23,25)(H,24,26)/t16-,21-/m0/s1
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359784
PNG
(9-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-...)
Show SMILES CC1CCCc2cc(cc(Br)c2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C20H23BrN2O3/c1-11-7-12(2)23-20(25)16(11)10-22-19(24)15-8-14-6-4-5-13(3)26-18(14)17(21)9-15/h7-9,13H,4-6,10H2,1-3H3,(H,22,24)(H,23,25)
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Bristol-Myers Squibb Company

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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359790
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES CC1CCCc2cc(cc(-c3ccc(nc3)N3CCNCC3)c2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C29H35N5O3/c1-18-13-19(2)33-29(36)25(18)17-32-28(35)23-14-21-6-4-5-20(3)37-27(21)24(15-23)22-7-8-26(31-16-22)34-11-9-30-10-12-34/h7-8,13-16,20,30H,4-6,9-12,17H2,1-3H3,(H,32,35)(H,33,36)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359825
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3c(OCC33CCCC3)c(c2)-c2ccc(nc2)N2CCNCC2)c(=O)[nH]1
Show InChI InChI=1S/C30H35N5O3/c1-19-13-20(2)34-29(37)24(19)17-33-28(36)22-14-23(27-25(15-22)30(18-38-27)7-3-4-8-30)21-5-6-26(32-16-21)35-11-9-31-10-12-35/h5-6,13-16,31H,3-4,7-12,17-18H2,1-2H3,(H,33,36)(H,34,37)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359841
PNG
(9-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc(Br)c3OC\C=C/COc3c2)c(=O)[nH]1
Show InChI InChI=1S/C19H19BrN2O4/c1-11-7-12(2)22-19(24)14(11)10-21-18(23)13-8-15(20)17-16(9-13)25-5-3-4-6-26-17/h3-4,7-9H,5-6,10H2,1-2H3,(H,21,23)(H,22,24)/b4-3-
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359737
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2ccc3OC(C)(C)Cc3c2C)c(=O)[nH]1
Show InChI InChI=1S/C20H24N2O3/c1-11-8-12(2)22-19(24)16(11)10-21-18(23)14-6-7-17-15(13(14)3)9-20(4,5)25-17/h6-8H,9-10H2,1-5H3,(H,21,23)(H,22,24)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359757
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES CC1COc2c1cc(cc2-c1ccc(nc1)N1CCOCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C27H30N4O4/c1-16-10-18(3)30-27(33)23(16)14-29-26(32)20-11-21-17(2)15-35-25(21)22(12-20)19-4-5-24(28-13-19)31-6-8-34-9-7-31/h4-5,10-13,17H,6-9,14-15H2,1-3H3,(H,29,32)(H,30,33)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359760
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES COc1ccc(cn1)-c1cc(cc2C(C)COc12)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C24H25N3O4/c1-13-7-15(3)27-24(29)20(13)11-26-23(28)17-8-18-14(2)12-31-22(18)19(9-17)16-5-6-21(30-4)25-10-16/h5-10,14H,11-12H2,1-4H3,(H,26,28)(H,27,29)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359766
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES COc1ccc(cn1)-c1cc(cc2CCOc12)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C23H23N3O4/c1-13-8-14(2)26-23(28)19(13)12-25-22(27)17-9-15-6-7-30-21(15)18(10-17)16-4-5-20(29-3)24-11-16/h4-5,8-11H,6-7,12H2,1-3H3,(H,25,27)(H,26,28)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359769
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES COc1ccc(cn1)-c1cc(cc2c1OCC2(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C25H27N3O4/c1-14-8-15(2)28-24(30)19(14)12-27-23(29)17-9-18(16-6-7-21(31-5)26-11-16)22-20(10-17)25(3,4)13-32-22/h6-11H,12-13H2,1-5H3,(H,27,29)(H,28,30)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359795
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES COc1ccc(cn1)-c1cc(cc2CC(C)(Oc12)C=C)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C26H27N3O4/c1-6-26(4)12-19-10-18(24(30)28-14-21-15(2)9-16(3)29-25(21)31)11-20(23(19)33-26)17-7-8-22(32-5)27-13-17/h6-11,13H,1,12,14H2,2-5H3,(H,28,30)(H,29,31)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359734
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(c2)C(F)(F)F)c(=O)[nH]1
Show InChI InChI=1S/C20H21F3N2O3/c1-10-5-11(2)25-18(27)14(10)9-24-17(26)12-6-13-8-19(3,4)28-16(13)15(7-12)20(21,22)23/h5-7H,8-9H2,1-4H3,(H,24,26)(H,25,27)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359772
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2ccc3OC(C)(C)CCc3c2)c(=O)[nH]1
Show InChI InChI=1S/C20H24N2O3/c1-12-9-13(2)22-19(24)16(12)11-21-18(23)15-5-6-17-14(10-15)7-8-20(3,4)25-17/h5-6,9-10H,7-8,11H2,1-4H3,(H,21,23)(H,22,24)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359773
PNG
(8-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc(Br)c3OC(C)(C)CCc3c2)c(=O)[nH]1
Show InChI InChI=1S/C20H23BrN2O3/c1-11-7-12(2)23-19(25)15(11)10-22-18(24)14-8-13-5-6-20(3,4)26-17(13)16(21)9-14/h7-9H,5-6,10H2,1-4H3,(H,22,24)(H,23,25)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359775
PNG
(9-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc(Br)c3OCC=C(C)Cc3c2)c(=O)[nH]1
Show InChI InChI=1S/C20H21BrN2O3/c1-11-4-5-26-18-14(6-11)8-15(9-17(18)21)19(24)22-10-16-12(2)7-13(3)23-20(16)25/h4,7-9H,5-6,10H2,1-3H3,(H,22,24)(H,23,25)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359777
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES COc1ccc(cn1)-c1cc(cc2CC(C)CCOc12)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C26H29N3O4/c1-15-7-8-33-24-19(9-15)11-20(12-21(24)18-5-6-23(32-4)27-13-18)25(30)28-14-22-16(2)10-17(3)29-26(22)31/h5-6,10-13,15H,7-9,14H2,1-4H3,(H,28,30)(H,29,31)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359799
PNG
(US9822103, Example 60 | t-Butyl 4-(5-(5-(((4,6-dim...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(Oc3c(c2)-c2cnc(nc2)N2CCN(CC2)C(=O)OC(C)(C)C)C=C)c(=O)[nH]1
Show InChI InChI=1S/C33H40N6O5/c1-8-33(7)16-23-14-22(28(40)34-19-26-20(2)13-21(3)37-29(26)41)15-25(27(23)43-33)24-17-35-30(36-18-24)38-9-11-39(12-10-38)31(42)44-32(4,5)6/h8,13-15,17-18H,1,9-12,16,19H2,2-7H3,(H,34,40)(H,37,41)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359797
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(Oc3c(c2)-c2ccc(CN3CCOCC3)cc2)C=C)c(=O)[nH]1
Show InChI InChI=1S/C31H35N3O4/c1-5-31(4)17-25-15-24(29(35)32-18-27-20(2)14-21(3)33-30(27)36)16-26(28(25)38-31)23-8-6-22(7-9-23)19-34-10-12-37-13-11-34/h5-9,14-16H,1,10-13,17-19H2,2-4H3,(H,32,35)(H,33,36)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359831
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES CC(C)C1Cc2cc(cc(c2O1)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C29H35N5O3/c1-17(2)25-14-21-12-22(28(35)32-16-24-18(3)11-19(4)33-29(24)36)13-23(27(21)37-25)20-5-6-26(31-15-20)34-9-7-30-8-10-34/h5-6,11-13,15,17,25,30H,7-10,14,16H2,1-4H3,(H,32,35)(H,33,36)
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Bristol-Myers Squibb Company

US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359833
PNG
(7-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-...)
Show SMILES CC(=C)C1(C)Cc2cc(cc(Br)c2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C21H23BrN2O3/c1-11(2)21(5)9-15-7-14(8-17(22)18(15)27-21)19(25)23-10-16-12(3)6-13(4)24-20(16)26/h6-8H,1,9-10H2,2-5H3,(H,23,25)(H,24,26)
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US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359842
PNG
(8-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc(Br)c3OC(COc3c2)C=C)c(=O)[nH]1
Show InChI InChI=1S/C19H19BrN2O4/c1-4-13-9-25-16-7-12(6-15(20)17(16)26-13)18(23)21-8-14-10(2)5-11(3)22-19(14)24/h4-7,13H,1,8-9H2,2-3H3,(H,21,23)(H,22,24)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359731
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES Cc1cc(C)c(CNC(=O)c2ccc3OC(C)(C)Cc3c2)c(=O)[nH]1
Show InChI InChI=1S/C19H22N2O3/c1-11-7-12(2)21-18(23)15(11)10-20-17(22)13-5-6-16-14(8-13)9-19(3,4)24-16/h5-8H,9-10H2,1-4H3,(H,20,22)(H,21,23)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359776
PNG
(9-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-...)
Show SMILES CC1COCc2c(Br)cc(cc2C1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C20H23BrN2O3/c1-11-4-14-6-15(7-18(21)17(14)10-26-9-11)19(24)22-8-16-12(2)5-13(3)23-20(16)25/h5-7,11H,4,8-10H2,1-3H3,(H,22,24)(H,23,25)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359780
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES CC1CCCc2cc(ccc2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C20H24N2O3/c1-12-9-13(2)22-20(24)17(12)11-21-19(23)16-7-8-18-15(10-16)6-4-5-14(3)25-18/h7-10,14H,4-6,11H2,1-3H3,(H,21,23)(H,22,24)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359785
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES CC1CCCc2cc(cc(-c3ccc(CN4CCOCC4)cc3)c2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C31H37N3O4/c1-20-15-21(2)33-31(36)28(20)18-32-30(35)26-16-25-6-4-5-22(3)38-29(25)27(17-26)24-9-7-23(8-10-24)19-34-11-13-37-14-12-34/h7-10,15-17,22H,4-6,11-14,18-19H2,1-3H3,(H,32,35)(H,33,36)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359791
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES COc1ccc(cn1)-c1cc(cc2CCCC(C)Oc12)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C26H29N3O4/c1-15-10-16(2)29-26(31)22(15)14-28-25(30)20-11-18-7-5-6-17(3)33-24(18)21(12-20)19-8-9-23(32-4)27-13-19/h8-13,17H,5-7,14H2,1-4H3,(H,28,30)(H,29,31)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359792
PNG
(9-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-...)
Show SMILES CC1CCc2cc(cc(Br)c2OC1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C20H23BrN2O3/c1-11-4-5-14-7-15(8-17(21)18(14)26-10-11)19(24)22-9-16-12(2)6-13(3)23-20(16)25/h6-8,11H,4-5,9-10H2,1-3H3,(H,22,24)(H,23,25)
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US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359796
PNG
(7-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(Oc3c(Br)c2)C=C)c(=O)[nH]1
Show InChI InChI=1S/C20H21BrN2O3/c1-5-20(4)9-14-7-13(8-16(21)17(14)26-20)18(24)22-10-15-11(2)6-12(3)23-19(15)25/h5-8H,1,9-10H2,2-4H3,(H,22,24)(H,23,25)
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US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359819
PNG
(US9822103, Example 73 | tert-Butyl 4-(5-(5-(((4,6-...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC4(CCCC4)Oc3c(c2)-c2cnc(nc2)N2CCN(CC2)C(=O)OC(C)(C)C)c(=O)[nH]1
Show InChI InChI=1S/C34H42N6O5/c1-21-14-22(2)38-30(42)27(21)20-35-29(41)23-15-24-17-34(8-6-7-9-34)44-28(24)26(16-23)25-18-36-31(37-19-25)39-10-12-40(13-11-39)32(43)45-33(3,4)5/h14-16,18-19H,6-13,17,20H2,1-5H3,(H,35,41)(H,38,42)
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US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359844
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES CCC1COc2cc(cc(-c3ccc(nc3)N3CCNCC3)c2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C28H33N5O4/c1-4-21-16-36-24-13-20(27(34)31-15-23-17(2)11-18(3)32-28(23)35)12-22(26(24)37-21)19-5-6-25(30-14-19)33-9-7-29-8-10-33/h5-6,11-14,21,29H,4,7-10,15-16H2,1-3H3,(H,31,34)(H,32,35)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359732
PNG
(7-Chloro-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(Cl)c2)c(=O)[nH]1
Show InChI InChI=1S/C19H21ClN2O3/c1-10-5-11(2)22-18(24)14(10)9-21-17(23)12-6-13-8-19(3,4)25-16(13)15(20)7-12/h5-7H,8-9H2,1-4H3,(H,21,23)(H,22,24)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359744
PNG
((E)-N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc3CC(C)(C)Oc3c(\C=C\c3ccccc3)c2)c(=O)[nH]1
Show InChI InChI=1S/C27H28N2O3/c1-17-12-18(2)29-26(31)23(17)16-28-25(30)21-13-20(11-10-19-8-6-5-7-9-19)24-22(14-21)15-27(3,4)32-24/h5-14H,15-16H2,1-4H3,(H,28,30)(H,29,31)/b11-10+
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359745
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES CN1CCN(CC1)C(=O)c1ccc(cc1)-c1cc(cc2CC(C)(C)Oc12)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C31H36N4O4/c1-19-14-20(2)33-29(37)26(19)18-32-28(36)23-15-24-17-31(3,4)39-27(24)25(16-23)21-6-8-22(9-7-21)30(38)35-12-10-34(5)11-13-35/h6-9,14-16H,10-13,17-18H2,1-5H3,(H,32,36)(H,33,37)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359762
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES COc1ccc(cn1)-c1cc(cc2CC(C)Oc12)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C24H25N3O4/c1-13-7-14(2)27-24(29)20(13)12-26-23(28)18-9-17-8-15(3)31-22(17)19(10-18)16-5-6-21(30-4)25-11-16/h5-7,9-11,15H,8,12H2,1-4H3,(H,26,28)(H,27,29)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359774
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES COc1ccc(cn1)-c1cc(cc2CCC(C)(C)Oc12)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C26H29N3O4/c1-15-10-16(2)29-25(31)21(15)14-28-24(30)19-11-17-8-9-26(3,4)33-23(17)20(12-19)18-6-7-22(32-5)27-13-18/h6-7,10-13H,8-9,14H2,1-5H3,(H,28,30)(H,29,31)
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US Patent


Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359779
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES CC1CC=Cc2cc(ccc2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C20H22N2O3/c1-12-9-13(2)22-20(24)17(12)11-21-19(23)16-7-8-18-15(10-16)6-4-5-14(3)25-18/h4,6-10,14H,5,11H2,1-3H3,(H,21,23)(H,22,24)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359794
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES CC1CCc2cc(cc(-c3ccc(nc3)N3CCNCC3)c2OC1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C29H35N5O3/c1-18-4-5-21-13-23(28(35)32-16-25-19(2)12-20(3)33-29(25)36)14-24(27(21)37-17-18)22-6-7-26(31-15-22)34-10-8-30-9-11-34/h6-7,12-15,18,30H,4-5,8-11,16-17H2,1-3H3,(H,32,35)(H,33,36)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359800
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES CCC1(C)Cc2cc(cc(c2O1)-c1ccc(OC)nc1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C26H29N3O4/c1-6-26(4)12-19-10-18(24(30)28-14-21-15(2)9-16(3)29-25(21)31)11-20(23(19)33-26)17-7-8-22(32-5)27-13-17/h7-11,13H,6,12,14H2,1-5H3,(H,28,30)(H,29,31)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359824
PNG
(N-((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)met...)
Show SMILES COc1ccc(cn1)-c1cc(cc2c1OCC21CCCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C27H29N3O4/c1-16-10-17(2)30-26(32)21(16)14-29-25(31)19-11-20(18-6-7-23(33-3)28-13-18)24-22(12-19)27(15-34-24)8-4-5-9-27/h6-7,10-13H,4-5,8-9,14-15H2,1-3H3,(H,29,31)(H,30,32)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359827
PNG
(7-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-...)
Show SMILES CC(C)C1Cc2cc(cc(Br)c2O1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C20H23BrN2O3/c1-10(2)17-8-13-6-14(7-16(21)18(13)26-17)19(24)22-9-15-11(3)5-12(4)23-20(15)25/h5-7,10,17H,8-9H2,1-4H3,(H,22,24)(H,23,25)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

More data for this
Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))		BDBM359832
PNG
(9-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-...)
Show SMILES Cc1cc(C)c(CNC(=O)c2cc(Br)c3OCC(C)=C(C)Cc3c2)c(=O)[nH]1
Show InChI InChI=1S/C21H23BrN2O3/c1-11-6-15-7-16(8-18(22)19(15)27-10-13(11)3)20(25)23-9-17-12(2)5-14(4)24-21(17)26/h5,7-8H,6,9-10H2,1-4H3,(H,23,25)(H,24,26)
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Assay Description
EZH2 Histone Methyl Transferase Assay: The effectiveness of compounds of the present invention as inhibitors of histone methyl transferases can be r...

US Patent US9822103 (2017)

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