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Compile Data Set for Download or QSAR

Found 210 hits Enz. Inhib. hit(s) with Target = 'EZH2(Y641F)' AND taxid = 9606   
Target
(Institution)
LigandTarget
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
EZH2(Y641F)


(Homo sapiens)
BDBM172085
PNG
(US9090562, 91)
Show SMILES CCNCc1ccc(cc1)-c1cc(N(CC)C2CCOCC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C32H42N4O3/c1-6-33-19-24-8-10-25(11-9-24)26-17-28(31(37)34-20-29-21(3)16-22(4)35-32(29)38)23(5)30(18-26)36(7-2)27-12-14-39-15-13-27/h8-11,16-18,27,33H,6-7,12-15,19-20H2,1-5H3,(H,34,37)(H,35,38)
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US Patent
n/an/a 0.520n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172163
PNG
(US9090562, 171)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(nc1)N1CCN(C)CC1
Show InChI InChI=1S/C33H44N6O3/c1-6-39(27-9-15-42-16-10-27)30-19-26(25-7-8-31(34-20-25)38-13-11-37(5)12-14-38)18-28(24(30)4)32(40)35-21-29-22(2)17-23(3)36-33(29)41/h7-8,17-20,27H,6,9-16,21H2,1-5H3,(H,35,40)(H,36,41)
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US Patent
n/an/a 0.760n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172087
PNG
(US9090562, 93)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CNCC2CC2)cc1
Show InChI InChI=1S/C34H44N4O3/c1-5-38(29-12-14-41-15-13-29)32-18-28(27-10-8-26(9-11-27)20-35-19-25-6-7-25)17-30(24(32)4)33(39)36-21-31-22(2)16-23(3)37-34(31)40/h8-11,16-18,25,29,35H,5-7,12-15,19-21H2,1-4H3,(H,36,39)(H,37,40)
PDB
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US Patent
n/an/a 0.870n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172080
PNG
(US9090562, 86)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCCNCC2)cc1
Show InChI InChI=1S/C35H47N5O3/c1-5-40(30-11-17-43-18-12-30)33-21-29(28-9-7-27(8-10-28)23-39-15-6-13-36-14-16-39)20-31(26(33)4)34(41)37-22-32-24(2)19-25(3)38-35(32)42/h7-10,19-21,30,36H,5-6,11-18,22-23H2,1-4H3,(H,37,41)(H,38,42)
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US Patent
n/an/a 1.12n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM190204
PNG
(EPZ008491 | US9175331, 35)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C(=O)N1CCC1
Show InChI InChI=1/C30H43N5O3/c1-7-35(24-11-9-23(10-12-24)33(5)6)27-17-22(30(38)34-13-8-14-34)16-25(21(27)4)28(36)31-18-26-19(2)15-20(3)32-29(26)37/h15-17,23-24H,7-14,18H2,1-6H3,(H,31,36)(H,32,37)/t23-,24-
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US Patent
n/an/a 1.40n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
Test compounds were serially diluted 3-fold in DMSO in a 10 point-curve and 1 uL was spotted into a 384-well microplate in duplicate using a Platemat...


US Patent US9175331 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM190202
PNG
(EPZ008337 | US9175331, 32)
Show SMILES CCN(C1CCC(CC1)N(C)C)c1cc(OC2CN(C)C2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C
Show InChI InChI=1S/C30H45N5O3/c1-8-35(23-11-9-22(10-12-23)33(5)6)28-15-24(38-25-17-34(7)18-25)14-26(21(28)4)29(36)31-16-27-19(2)13-20(3)32-30(27)37/h13-15,22-23,25H,8-12,16-18H2,1-7H3,(H,31,36)(H,32,37)
PDB
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US Patent
n/an/a 1.5n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
Test compounds were serially diluted 3-fold in DMSO in a 10 point-curve and 1 uL was spotted into a 384-well microplate in duplicate using a Platemat...


US Patent US9175331 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172174
PNG
(EPZ008681 | US9090562, 182 | US9175331, 44)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(cc1)C(=O)NCCCO
Show InChI InChI=1/C36H49N5O4/c1-7-41(30-15-13-29(14-16-30)40(5)6)33-21-28(26-9-11-27(12-10-26)34(43)37-17-8-18-42)20-31(25(33)4)35(44)38-22-32-23(2)19-24(3)39-36(32)45/h9-12,19-21,29-30,42H,7-8,13-18,22H2,1-6H3,(H,37,43)(H,38,44)(H,39,45)/t29-,30-
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US Patent
n/an/a 1.5n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
Test compounds were serially diluted 3-fold in DMSO in a 10 point-curve and 1 uL was spotted into a 384-well microplate in duplicate using a Platemat...


US Patent US9175331 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172089
PNG
(US9090562, 95)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CNC[C@@H](O)CO)cc1
Show InChI InChI=1/C33H44N4O5/c1-5-37(27-10-12-42-13-11-27)31-16-26(25-8-6-24(7-9-25)17-34-18-28(39)20-38)15-29(23(31)4)32(40)35-19-30-21(2)14-22(3)36-33(30)41/h6-9,14-16,27-28,34,38-39H,5,10-13,17-20H2,1-4H3,(H,35,40)(H,36,41)/t28-/s2
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US Patent
n/an/a 1.55n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM190223
PNG
(EPZ009158 | US9175331, 60)
Show SMILES CCN(C1CCC(CO)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C
Show InChI InChI=1S/C25H34ClN3O3/c1-5-29(20-8-6-18(14-30)7-9-20)23-12-19(26)11-21(17(23)4)24(31)27-13-22-15(2)10-16(3)28-25(22)32/h10-12,18,20,30H,5-9,13-14H2,1-4H3,(H,27,31)(H,28,32)
PDB
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US Patent
n/an/a 1.60n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
Test compounds were serially diluted 3-fold in DMSO in a 10 point-curve and 1 uL was spotted into a 384-well microplate in duplicate using a Platemat...


US Patent US9175331 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172162
PNG
(US9090562, 170)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(nc1)N1CCN(C)CC1
Show InChI InChI=1/C36H51N7O2/c1-8-43(30-12-10-29(11-13-30)40(5)6)33-21-28(27-9-14-34(37-22-27)42-17-15-41(7)16-18-42)20-31(26(33)4)35(44)38-23-32-24(2)19-25(3)39-36(32)45/h9,14,19-22,29-30H,8,10-13,15-18,23H2,1-7H3,(H,38,44)(H,39,45)/t29-,30-
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US Patent
n/an/a 1.63n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172181
PNG
(US9090562, 189)
Show SMILES CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc(N(CC)C2CCOCC2)c1C)-c1ccc(nc1)N1CCN(CC1)C1CCN(C)CC1
Show InChI InChI=1S/C40H57N7O3/c1-6-8-30-23-28(3)43-40(49)36(30)27-42-39(48)35-24-32(25-37(29(35)4)47(7-2)34-13-21-50-22-14-34)31-9-10-38(41-26-31)46-19-17-45(18-20-46)33-11-15-44(5)16-12-33/h9-10,23-26,33-34H,6-8,11-22,27H2,1-5H3,(H,42,48)(H,43,49)
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US Patent
n/an/a 1.82n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172135
PNG
(EPZ007210 | US9090562, 141 | US9175331, 13)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)nc2=O)c1C)-c1ccc(CN2CCOCC2)cc1
Show InChI InChI=1/C37H50N5O3/c1-7-42(32-14-12-31(13-15-32)40(5)6)35-22-30(29-10-8-28(9-11-29)24-41-16-18-45-19-17-41)21-33(27(35)4)36(43)38-23-34-25(2)20-26(3)39-37(34)44/h8-11,20-22,31-32H,7,12-19,23-24H2,1-6H3,(H,38,43)/t31-,32-
PDB
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US Patent
n/an/a 1.95n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172088
PNG
(US9090562, 94)
Show SMILES CCN(CC)Cc1ccc(cc1)-c1cc(N(CC)C2CCOCC2)c(C)c(c1)C(=O)NCc1c(C)cc(C)[nH]c1=O
Show InChI InChI=1S/C34H46N4O3/c1-7-37(8-2)22-26-10-12-27(13-11-26)28-19-30(33(39)35-21-31-23(4)18-24(5)36-34(31)40)25(6)32(20-28)38(9-3)29-14-16-41-17-15-29/h10-13,18-20,29H,7-9,14-17,21-22H2,1-6H3,(H,35,39)(H,36,40)
PDB
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US Patent
n/an/a 2.07n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172065
PNG
(US9090562, 71)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CC[C@@H](O)C2)cc1
Show InChI InChI=1/C34H44N4O4/c1-5-38(28-11-14-42-15-12-28)32-18-27(26-8-6-25(7-9-26)20-37-13-10-29(39)21-37)17-30(24(32)4)33(40)35-19-31-22(2)16-23(3)36-34(31)41/h6-9,16-18,28-29,39H,5,10-15,19-21H2,1-4H3,(H,35,40)(H,36,41)/t29-/s2
PDB
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US Patent
n/an/a 2.19n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172173
PNG
(US9090562, 181)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(cc1)C(=O)N1CCC1
Show InChI InChI=1/C36H47N5O3/c1-7-41(30-15-13-29(14-16-30)39(5)6)33-21-28(26-9-11-27(12-10-26)36(44)40-17-8-18-40)20-31(25(33)4)34(42)37-22-32-23(2)19-24(3)38-35(32)43/h9-12,19-21,29-30H,7-8,13-18,22H2,1-6H3,(H,37,42)(H,38,43)/t29-,30-
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US Patent
n/an/a 2.23n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM190199
PNG
(EPZ008286 | US9175331, 29)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C#CC1CC1
Show InChI InChI=1/C31H42N4O2/c1-7-35(26-14-12-25(13-15-26)34(5)6)29-18-24(11-10-23-8-9-23)17-27(22(29)4)30(36)32-19-28-20(2)16-21(3)33-31(28)37/h16-18,23,25-26H,7-9,12-15,19H2,1-6H3,(H,32,36)(H,33,37)/t25-,26-
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US Patent
n/an/a 2.5n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
Test compounds were serially diluted 3-fold in DMSO in a 10 point-curve and 1 uL was spotted into a 384-well microplate in duplicate using a Platemat...


US Patent US9175331 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172093
PNG
(US9090562, 99)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CNCCCO)cc1
Show InChI InChI=1S/C33H44N4O4/c1-5-37(28-11-15-41-16-12-28)31-19-27(26-9-7-25(8-10-26)20-34-13-6-14-38)18-29(24(31)4)32(39)35-21-30-22(2)17-23(3)36-33(30)40/h7-10,17-19,28,34,38H,5-6,11-16,20-21H2,1-4H3,(H,35,39)(H,36,40)
PDB
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US Patent
n/an/a 2.56n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172063
PNG
(US9090562, 69)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCCC2)cc1
Show InChI InChI=1S/C34H44N4O3/c1-5-38(29-12-16-41-17-13-29)32-20-28(27-10-8-26(9-11-27)22-37-14-6-7-15-37)19-30(25(32)4)33(39)35-21-31-23(2)18-24(3)36-34(31)40/h8-11,18-20,29H,5-7,12-17,21-22H2,1-4H3,(H,35,39)(H,36,40)
PDB
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US Patent
n/an/a 2.60n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172161
PNG
(US9090562, 169)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1nccn1C
Show InChI InChI=1/C30H42N6O2/c1-8-36(24-11-9-23(10-12-24)34(5)6)27-17-22(28-31-13-14-35(28)7)16-25(21(27)4)29(37)32-18-26-19(2)15-20(3)33-30(26)38/h13-17,23-24H,8-12,18H2,1-7H3,(H,32,37)(H,33,38)/t23-,24-
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US Patent
n/an/a 2.74n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172076
PNG
(US9090562, 82)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCC2)cc1
Show InChI InChI=1S/C33H42N4O3/c1-5-37(28-11-15-40-16-12-28)31-19-27(26-9-7-25(8-10-26)21-36-13-6-14-36)18-29(24(31)4)32(38)34-20-30-22(2)17-23(3)35-33(30)39/h7-10,17-19,28H,5-6,11-16,20-21H2,1-4H3,(H,34,38)(H,35,39)
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US Patent
n/an/a 2.81n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172183
PNG
(US9090562, 191)
Show SMILES CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc(N(CC)C2CCOCC2)c1C)-c1ccc(CN2CCOCC2)nc1
Show InChI InChI=1S/C35H47N5O4/c1-5-7-26-18-24(3)38-35(42)32(26)22-37-34(41)31-19-28(20-33(25(31)4)40(6-2)30-10-14-43-15-11-30)27-8-9-29(36-21-27)23-39-12-16-44-17-13-39/h8-9,18-21,30H,5-7,10-17,22-23H2,1-4H3,(H,37,41)(H,38,42)
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US Patent
n/an/a 2.82n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172166
PNG
(EPZ008280 | US9090562, 174 | US9175331, 28)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnccn1
Show InChI InChI=1/C30H40N6O2/c1-7-36(24-10-8-23(9-11-24)35(5)6)28-16-22(27-18-31-12-13-32-27)15-25(21(28)4)29(37)33-17-26-19(2)14-20(3)34-30(26)38/h12-16,18,23-24H,7-11,17H2,1-6H3,(H,33,37)(H,34,38)/t23-,24-
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n/an/a 2.89n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM190208
PNG
(EPZ008630 | US9175331, 43)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Br)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1Cl
Show InChI InChI=1/C25H34BrClN4O2/c1-6-31(19-9-7-18(8-10-19)30(4)5)22-13-17(26)12-20(23(22)27)24(32)28-14-21-15(2)11-16(3)29-25(21)33/h11-13,18-19H,6-10,14H2,1-5H3,(H,28,32)(H,29,33)/t18-,19-
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US Patent
n/an/a 2.90n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
Test compounds were serially diluted 3-fold in DMSO in a 10 point-curve and 1 uL was spotted into a 384-well microplate in duplicate using a Platemat...


US Patent US9175331 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172166
PNG
(EPZ008280 | US9090562, 174 | US9175331, 28)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cnccn1
Show InChI InChI=1/C30H40N6O2/c1-7-36(24-10-8-23(9-11-24)35(5)6)28-16-22(27-18-31-12-13-32-27)15-25(21(28)4)29(37)33-17-26-19(2)14-20(3)34-30(26)38/h12-16,18,23-24H,7-11,17H2,1-6H3,(H,33,37)(H,34,38)/t23-,24-
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US Patent
n/an/a 2.90n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
Test compounds were serially diluted 3-fold in DMSO in a 10 point-curve and 1 uL was spotted into a 384-well microplate in duplicate using a Platemat...


US Patent US9175331 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172091
PNG
(US9090562, 97)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN(C)CC2CC2)cc1
Show InChI InChI=1S/C35H46N4O3/c1-6-39(30-13-15-42-16-14-30)33-19-29(28-11-9-27(10-12-28)22-38(5)21-26-7-8-26)18-31(25(33)4)34(40)36-20-32-23(2)17-24(3)37-35(32)41/h9-12,17-19,26,30H,6-8,13-16,20-22H2,1-5H3,(H,36,40)(H,37,41)
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n/an/a 2.96n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM190217
PNG
(EPZ009152 | US9175331, 54)
Show SMILES CCOC(=O)[C@H]1CC[C@@H](CC1)N(CC)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C
Show InChI InChI=1/C27H36ClN3O4/c1-6-31(21-10-8-19(9-11-21)27(34)35-7-2)24-14-20(28)13-22(18(24)5)25(32)29-15-23-16(3)12-17(4)30-26(23)33/h12-14,19,21H,6-11,15H2,1-5H3,(H,29,32)(H,30,33)/t19-,21-
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US Patent
n/an/a 3.10n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
Test compounds were serially diluted 3-fold in DMSO in a 10 point-curve and 1 uL was spotted into a 384-well microplate in duplicate using a Platemat...


US Patent US9175331 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM190218
PNG
(EPZ009153 | US9175331, 55)
Show SMILES CCOC(=O)[C@@H]1CC[C@@H](CC1)N(CC)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C
Show InChI InChI=1/C27H36ClN3O4/c1-6-31(21-10-8-19(9-11-21)27(34)35-7-2)24-14-20(28)13-22(18(24)5)25(32)29-15-23-16(3)12-17(4)30-26(23)33/h12-14,19,21H,6-11,15H2,1-5H3,(H,29,32)(H,30,33)/t19-,21+
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US Patent
n/an/a 3.20n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
Test compounds were serially diluted 3-fold in DMSO in a 10 point-curve and 1 uL was spotted into a 384-well microplate in duplicate using a Platemat...


US Patent US9175331 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM190200
PNG
(EPZ008335 | US9175331, 30)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1CC
Show InChI InChI=1/C27H39ClN4O2/c1-7-22-23(26(33)29-16-24-17(3)13-18(4)30-27(24)34)14-19(28)15-25(22)32(8-2)21-11-9-20(10-12-21)31(5)6/h13-15,20-21H,7-12,16H2,1-6H3,(H,29,33)(H,30,34)/t20-,21-
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US Patent
n/an/a 3.30n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
Test compounds were serially diluted 3-fold in DMSO in a 10 point-curve and 1 uL was spotted into a 384-well microplate in duplicate using a Platemat...


US Patent US9175331 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM190184
PNG
(EPZ006632 | US9175331, 10)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)nc2=O)c1C)-c1ccc(CN2CCCN(C)CC2)cc1
Show InChI InChI=1S/C36H48N5O3/c1-6-41(31-12-18-44-19-13-31)34-22-30(29-10-8-28(9-11-29)24-40-15-7-14-39(5)16-17-40)21-32(27(34)4)35(42)37-23-33-25(2)20-26(3)38-36(33)43/h8-11,20-22,31H,6-7,12-19,23-24H2,1-5H3,(H,37,42)
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n/an/a 3.40n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
Test compounds were serially diluted 3-fold in DMSO in a 10 point-curve and 1 uL was spotted into a 384-well microplate in duplicate using a Platemat...


US Patent US9175331 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172069
PNG
(US9090562, 75)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCCCC2)cc1
Show InChI InChI=1S/C35H46N4O3/c1-5-39(30-13-17-42-18-14-30)33-21-29(28-11-9-27(10-12-28)23-38-15-7-6-8-16-38)20-31(26(33)4)34(40)36-22-32-24(2)19-25(3)37-35(32)41/h9-12,19-21,30H,5-8,13-18,22-23H2,1-4H3,(H,36,40)(H,37,41)
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n/an/a 3.48n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM190203
PNG
(EPZ008344 | US9175331, 34)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C#CC(C)(C)O
Show InChI InChI=1/C31H44N4O3/c1-9-35(25-12-10-24(11-13-25)34(7)8)28-18-23(14-15-31(5,6)38)17-26(22(28)4)29(36)32-19-27-20(2)16-21(3)33-30(27)37/h16-18,24-25,38H,9-13,19H2,1-8H3,(H,32,36)(H,33,37)/t24-,25-
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US Patent
n/an/a 3.60n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
Test compounds were serially diluted 3-fold in DMSO in a 10 point-curve and 1 uL was spotted into a 384-well microplate in duplicate using a Platemat...


US Patent US9175331 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM190201
PNG
(EPZ008336 | US9175331, 31)
Show SMILES CCN([C@@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1CC
Show InChI InChI=1/C27H39ClN4O2/c1-7-22-23(26(33)29-16-24-17(3)13-18(4)30-27(24)34)14-19(28)15-25(22)32(8-2)21-11-9-20(10-12-21)31(5)6/h13-15,20-21H,7-12,16H2,1-6H3,(H,29,33)(H,30,34)/t20-,21+
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US Patent
n/an/a 3.60n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
Test compounds were serially diluted 3-fold in DMSO in a 10 point-curve and 1 uL was spotted into a 384-well microplate in duplicate using a Platemat...


US Patent US9175331 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172084
PNG
(US9090562, 90)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CNC)cc1
Show InChI InChI=1S/C31H40N4O3/c1-6-35(26-11-13-38-14-12-26)29-17-25(24-9-7-23(8-10-24)18-32-5)16-27(22(29)4)30(36)33-19-28-20(2)15-21(3)34-31(28)37/h7-10,15-17,26,32H,6,11-14,18-19H2,1-5H3,(H,33,36)(H,34,37)
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n/an/a 3.61n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172177
PNG
(US9090562, 185)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(cc(C)[nH]c2=O)C(C)C)c1C)-c1ccc(nc1)N1CCNCC1
Show InChI InChI=1S/C34H46N6O3/c1-6-40(27-9-15-43-16-10-27)31-19-26(25-7-8-32(36-20-25)39-13-11-35-12-14-39)18-29(24(31)5)33(41)37-21-30-28(22(2)3)17-23(4)38-34(30)42/h7-8,17-20,22,27,35H,6,9-16,21H2,1-5H3,(H,37,41)(H,38,42)
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n/an/a 3.74n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172175
PNG
(EPZ009097 | US9090562, 183 | US9175331, 52)
Show SMILES CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc(N(CC)C2CCOCC2)c1C)-c1ccc(nc1)N1CCN(C)CC1
Show InChI InChI=1S/C35H48N6O3/c1-6-8-26-19-24(3)38-35(43)31(26)23-37-34(42)30-20-28(21-32(25(30)4)41(7-2)29-11-17-44-18-12-29)27-9-10-33(36-22-27)40-15-13-39(5)14-16-40/h9-10,19-22,29H,6-8,11-18,23H2,1-5H3,(H,37,42)(H,38,43)
PDB
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n/an/a 3.87n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172074
PNG
(US9090562, 80)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCC(F)CC2)cc1
Show InChI InChI=1S/C35H45FN4O3/c1-5-40(30-12-16-43-17-13-30)33-20-28(27-8-6-26(7-9-27)22-39-14-10-29(36)11-15-39)19-31(25(33)4)34(41)37-21-32-23(2)18-24(3)38-35(32)42/h6-9,18-20,29-30H,5,10-17,21-22H2,1-4H3,(H,37,41)(H,38,42)
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n/an/a 3.88n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172175
PNG
(EPZ009097 | US9090562, 183 | US9175331, 52)
Show SMILES CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc(N(CC)C2CCOCC2)c1C)-c1ccc(nc1)N1CCN(C)CC1
Show InChI InChI=1S/C35H48N6O3/c1-6-8-26-19-24(3)38-35(43)31(26)23-37-34(42)30-20-28(21-32(25(30)4)41(7-2)29-11-17-44-18-12-29)27-9-10-33(36-22-27)40-15-13-39(5)14-16-40/h9-10,19-22,29H,6-8,11-18,23H2,1-5H3,(H,37,42)(H,38,43)
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US Patent
n/an/a 3.90n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
Test compounds were serially diluted 3-fold in DMSO in a 10 point-curve and 1 uL was spotted into a 384-well microplate in duplicate using a Platemat...


US Patent US9175331 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172077
PNG
(US9090562, 83)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CC(O)C2)cc1
Show InChI InChI=1S/C33H42N4O4/c1-5-37(27-10-12-41-13-11-27)31-16-26(25-8-6-24(7-9-25)18-36-19-28(38)20-36)15-29(23(31)4)32(39)34-17-30-21(2)14-22(3)35-33(30)40/h6-9,14-16,27-28,38H,5,10-13,17-20H2,1-4H3,(H,34,39)(H,35,40)
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n/an/a 4.18n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172164
PNG
(US9090562, 172)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(nc1)N1CCNCC1
Show InChI InChI=1/C35H49N7O2/c1-7-42(29-11-9-28(10-12-29)40(5)6)32-20-27(26-8-13-33(37-21-26)41-16-14-36-15-17-41)19-30(25(32)4)34(43)38-22-31-23(2)18-24(3)39-35(31)44/h8,13,18-21,28-29,36H,7,9-12,14-17,22H2,1-6H3,(H,38,43)(H,39,44)/t28-,29-
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n/an/a 4.21n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172081
PNG
(US9090562, 87)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCCN(C)CC2)cc1
Show InChI InChI=1S/C36H49N5O3/c1-6-41(31-12-18-44-19-13-31)34-22-30(29-10-8-28(9-11-29)24-40-15-7-14-39(5)16-17-40)21-32(27(34)4)35(42)37-23-33-25(2)20-26(3)38-36(33)43/h8-11,20-22,31H,6-7,12-19,23-24H2,1-5H3,(H,37,42)(H,38,43)
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n/an/a 4.29n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172135
PNG
(EPZ007210 | US9090562, 141 | US9175331, 13)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)nc2=O)c1C)-c1ccc(CN2CCOCC2)cc1
Show InChI InChI=1/C37H50N5O3/c1-7-42(32-14-12-31(13-15-32)40(5)6)35-22-30(29-10-8-28(9-11-29)24-41-16-18-45-19-17-41)21-33(27(35)4)36(43)38-23-34-25(2)20-26(3)39-37(34)44/h8-11,20-22,31-32H,7,12-19,23-24H2,1-6H3,(H,38,43)/t31-,32-
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n/an/a 4.40n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
Test compounds were serially diluted 3-fold in DMSO in a 10 point-curve and 1 uL was spotted into a 384-well microplate in duplicate using a Platemat...


US Patent US9175331 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172109
PNG
(US9090562, 115)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)nc2=O)c1C)-c1ccc(CN2CC(CN3CCOCC3)C2)cc1
Show InChI InChI=1S/C38H50N5O4/c1-5-43(33-10-14-46-15-11-33)36-20-32(19-34(28(36)4)37(44)39-21-35-26(2)18-27(3)40-38(35)45)31-8-6-29(7-9-31)22-42-24-30(25-42)23-41-12-16-47-17-13-41/h6-9,18-20,30,33H,5,10-17,21-25H2,1-4H3,(H,39,44)
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n/an/a 4.46n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172134
PNG
(US9090562, 140)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)nc2=O)c1C)-c1ccc(CN2CCOCC2)c(c1)C#N
Show InChI InChI=1S/C35H42N5O4/c1-5-40(30-8-12-43-13-9-30)33-19-28(26-6-7-27(29(17-26)20-36)22-39-10-14-44-15-11-39)18-31(25(33)4)34(41)37-21-32-23(2)16-24(3)38-35(32)42/h6-7,16-19,30H,5,8-15,21-22H2,1-4H3,(H,37,41)
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n/an/a 4.54n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM190206
PNG
(EPZ008494 | US9175331, 37)
Show SMILES CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(Cl)cc(N(CC)[C@H]2CC[C@@H](CC2)N(C)C)c1C
Show InChI InChI=1/C28H41ClN4O2/c1-7-9-20-14-18(3)31-28(35)25(20)17-30-27(34)24-15-21(29)16-26(19(24)4)33(8-2)23-12-10-22(11-13-23)32(5)6/h14-16,22-23H,7-13,17H2,1-6H3,(H,30,34)(H,31,35)/t22-,23-
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US Patent
n/an/a 4.60n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
Test compounds were serially diluted 3-fold in DMSO in a 10 point-curve and 1 uL was spotted into a 384-well microplate in duplicate using a Platemat...


US Patent US9175331 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172153
PNG
(US9090562, 161)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccn(C)n1
Show InChI InChI=1/C30H42N6O2/c1-8-36(24-11-9-23(10-12-24)34(5)6)28-17-22(27-13-14-35(7)33-27)16-25(21(28)4)29(37)31-18-26-19(2)15-20(3)32-30(26)38/h13-17,23-24H,8-12,18H2,1-7H3,(H,31,37)(H,32,38)/t23-,24-
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n/an/a 4.71n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172072
PNG
(US9090562, 78)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(CN2CCC(O)CC2)cc1
Show InChI InChI=1S/C35H46N4O4/c1-5-39(29-12-16-43-17-13-29)33-20-28(27-8-6-26(7-9-27)22-38-14-10-30(40)11-15-38)19-31(25(33)4)34(41)36-21-32-23(2)18-24(3)37-35(32)42/h6-9,18-20,29-30,40H,5,10-17,21-22H2,1-4H3,(H,36,41)(H,37,42)
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n/an/a 4.76n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172157
PNG
(US9090562, 165)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1cn(C)nc1C
Show InChI InChI=1/C31H44N6O2/c1-9-37(25-12-10-24(11-13-25)35(6)7)29-16-23(28-18-36(8)34-22(28)5)15-26(21(29)4)30(38)32-17-27-19(2)14-20(3)33-31(27)39/h14-16,18,24-25H,9-13,17H2,1-8H3,(H,32,38)(H,33,39)/t24-,25-
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n/an/a 4.98n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172133
PNG
(US9090562, 139)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)nc2=O)c1CC)-c1ccc(CN2CCOCC2)cc1
Show InChI InChI=1S/C35H45N4O4/c1-5-30-31(34(40)36-22-32-24(3)19-25(4)37-35(32)41)20-28(21-33(30)39(6-2)29-11-15-42-16-12-29)27-9-7-26(8-10-27)23-38-13-17-43-18-14-38/h7-10,19-21,29H,5-6,11-18,22-23H2,1-4H3,(H,36,40)
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n/an/a 5.03n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172170
PNG
(EPZ008592 | US9090562, 178 | US9175331, 41)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1Cl)-c1ccc(CN2CCOCC2)cc1
Show InChI InChI=1S/C33H41ClN4O4/c1-4-38(27-9-13-41-14-10-27)30-19-26(25-7-5-24(6-8-25)21-37-11-15-42-16-12-37)18-28(31(30)34)32(39)35-20-29-22(2)17-23(3)36-33(29)40/h5-8,17-19,27H,4,9-16,20-21H2,1-3H3,(H,35,39)(H,36,40)
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n/an/a 5.07n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
EZH2(Y641F)


(Homo sapiens)
BDBM172150
PNG
(US9090562, 158)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)-c1ccc(C)nc1
Show InChI InChI=1/C32H43N5O2/c1-8-37(27-13-11-26(12-14-27)36(6)7)30-17-25(24-10-9-21(3)33-18-24)16-28(23(30)5)31(38)34-19-29-20(2)15-22(4)35-32(29)39/h9-10,15-18,26-27H,8,11-14,19H2,1-7H3,(H,34,38)(H,35,39)/t26-,27-
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n/an/a 5.09n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were all performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG and 0.002% Tween20, prepared on the day of use....


US Patent US9090562 (2015)

More data for this
Ligand-Target Pair
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