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Patent code US10150764

Compile Data Set for Download or QSAR
Found 139 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
EZH2(Y641F)


(Homo sapiens)
BDBM310800
PNG
(US10150764, Compound 86)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)n(C)[nH]c2=O)c1C
PDB
MMDB

KEGG

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310795
PNG
(US10150764, Compound 81)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(N3CCCC3)n(C)[nH]c2=O)c1C
PDB
MMDB

KEGG

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 5n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310743
PNG
(US10150764, Compound 30)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)[nH][nH]c2=O)c1C)-c1ccc(OCCOC)cc1
Show InChI InChI=1S/C32H43N5O4/c1-7-37(26-12-10-25(11-13-26)36(4)5)30-19-24(23-8-14-27(15-9-23)41-17-16-40-6)18-28(21(30)2)31(38)33-20-29-22(3)34-35-32(29)39/h8-9,14-15,18-19,25-26H,7,10-13,16-17,20H2,1-6H3,(H,33,38)/t25-,26-
PDB
MMDB

KEGG

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 7n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310807
PNG
(US10150764, Compound 93)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(N3CCCCC3)n(C)[nH]c2=O)c1C
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 9.71n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310772
PNG
(US10150764, Compound 57)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OC)c1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C
PDB
MMDB

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DrugBank
GoogleScholar
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PC cid
PC sid
UniChem
US Patent
n/an/a 10n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310771
PNG
(US10150764, Compound 56)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1ccc(OC)cc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C
PDB
MMDB

KEGG

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 11n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310777
PNG
(US10150764, Compound 63)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OC)c1)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)[nH]c2=O)c1C
PDB
MMDB

KEGG

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 12n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310784
PNG
(US10150764, Compound 70)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1ccc(OC)cc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)nc2OC)c1C
Show InChI InChI=1S/C33H46ClN5O3/c1-8-38(27-14-12-26(13-15-27)37(5)21-24-10-16-28(41-6)17-11-24)31-19-25(34)18-29(22(31)3)32(40)35-20-30-23(4)39(9-2)36-33(30)42-7/h10-11,16-19,26-27H,8-9,12-15,20-21H2,1-7H3,(H,35,40)/t26-,27-
PDB
MMDB

KEGG

B.MOAD
DrugBank
GoogleScholar
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PC cid
PC sid
UniChem
US Patent
n/an/a 12n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310747
PNG
(US10150764, Compound 33a)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]nc2OC)c1C
PDB
MMDB

KEGG

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 13n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310807
PNG
(US10150764, Compound 93)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(N3CCCCC3)n(C)[nH]c2=O)c1C
PDB
MMDB

KEGG

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 14.4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310746
PNG
(US10150764, Compound 32)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)[nH][nH]c2=O)c1C
Show InChI InChI=1S/C23H32ClN5O2/c1-6-29(18-9-7-17(8-10-18)28(4)5)21-12-16(24)11-19(14(21)2)22(30)25-13-20-15(3)26-27-23(20)31/h11-12,17-18H,6-10,13H2,1-5H3,(H,25,30)/t17-,18-
PDB
MMDB

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PC sid
UniChem
US Patent
n/an/a 15n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310795
PNG
(US10150764, Compound 81)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(N3CCCC3)n(C)[nH]c2=O)c1C
PDB

KEGG

UniProtKB/SwissProt

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GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 18n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310772
PNG
(US10150764, Compound 57)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OC)c1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 20n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310800
PNG
(US10150764, Compound 86)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)n(C)[nH]c2=O)c1C
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 21n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310743
PNG
(US10150764, Compound 30)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)[nH][nH]c2=O)c1C)-c1ccc(OCCOC)cc1
Show InChI InChI=1S/C32H43N5O4/c1-7-37(26-12-10-25(11-13-26)36(4)5)30-19-24(23-8-14-27(15-9-23)41-17-16-40-6)18-28(21(30)2)31(38)33-20-29-22(3)34-35-32(29)39/h8-9,14-15,18-19,25-26H,7,10-13,16-17,20H2,1-6H3,(H,33,38)/t25-,26-
PDB

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UniProtKB/SwissProt

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GoogleScholar
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PC cid
PC sid
UniChem
US Patent
n/an/a 24n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310771
PNG
(US10150764, Compound 56)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1ccc(OC)cc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 25n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310767
PNG
(US10150764, Compound 52)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)[nH]c2=O)c1C
PDB
MMDB

KEGG

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 30n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310783
PNG
(US10150764, Compound 69)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OCCOC)c1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C
PDB
MMDB

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B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 31n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310747
PNG
(US10150764, Compound 33a)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]nc2OC)c1C
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 38n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310784
PNG
(US10150764, Compound 70)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1ccc(OC)cc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)nc2OC)c1C
Show InChI InChI=1S/C33H46ClN5O3/c1-8-38(27-14-12-26(13-15-27)37(5)21-24-10-16-28(41-6)17-11-24)31-19-25(34)18-29(22(31)3)32(40)35-20-30-23(4)39(9-2)36-33(30)42-7/h10-11,16-19,26-27H,8-9,12-15,20-21H2,1-7H3,(H,35,40)/t26-,27-
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 39n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310769
PNG
(US10150764, Compound 54)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1
PDB
MMDB

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B.MOAD
DrugBank
GoogleScholar
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PC cid
PC sid
UniChem
US Patent
n/an/a 39n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310777
PNG
(US10150764, Compound 63)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OC)c1)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)[nH]c2=O)c1C
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 46n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310781
PNG
(US10150764, Compound 67 | US10150764, Compound 73)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccnc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C
PDB
MMDB

KEGG

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 60n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310750
PNG
(US10150764, Compound 35)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C)-c1ccc(OCCOC)cc1
PDB
MMDB

KEGG

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 63n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310746
PNG
(US10150764, Compound 32)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)[nH][nH]c2=O)c1C
Show InChI InChI=1S/C23H32ClN5O2/c1-6-29(18-9-7-17(8-10-18)28(4)5)21-12-16(24)11-19(14(21)2)22(30)25-13-20-15(3)26-27-23(20)31/h11-12,17-18H,6-10,13H2,1-5H3,(H,25,30)/t17-,18-
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 68n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310739
PNG
(US10150764, Compound 1)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(CCN(C)C)cc3CCNn3c2=O)c1C
Show InChI InChI=1S/C30H45ClN6O2/c1-7-36(24-10-8-23(9-11-24)35(5)6)28-18-22(31)17-26(20(28)2)29(38)32-19-27-21(13-15-34(3)4)16-25-12-14-33-37(25)30(27)39/h16-18,23-24,33H,7-15,19H2,1-6H3,(H,32,38)/t23-,24-
PDB

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n/an/a 75n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310793
PNG
(US10150764, Compound 79)
Show SMILES CCN(C1CCN(CCc2cccc(OC)c2)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C
PDB
MMDB

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n/an/a 100n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310749
PNG
(US10150764, Compound 34)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C
PDB
MMDB

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n/an/a 110n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310751
PNG
(US10150764, Compound 36)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(CC)c2=O)c1C
PDB
MMDB

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n/an/a 114n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310783
PNG
(US10150764, Compound 69)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OCCOC)c1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C
PDB

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n/an/a 136n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310739
PNG
(US10150764, Compound 1)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(CCN(C)C)cc3CCNn3c2=O)c1C
Show InChI InChI=1S/C30H45ClN6O2/c1-7-36(24-10-8-23(9-11-24)35(5)6)28-18-22(31)17-26(20(28)2)29(38)32-19-27-21(13-15-34(3)4)16-25-12-14-33-37(25)30(27)39/h16-18,23-24,33H,7-15,19H2,1-6H3,(H,32,38)/t23-,24-
PDB
MMDB

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n/an/a 149n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310781
PNG
(US10150764, Compound 67 | US10150764, Compound 73)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccnc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C
PDB
MMDB

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n/an/a 149n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310755
PNG
(US10150764, Compound 40)
Show SMILES CCCCc1[nH]n(C)c(=O)c1CNC(=O)c1cc(Cl)cc(N(CC)[C@H]2CC[C@@H](CC2)N(C)C)c1C
PDB
MMDB

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n/an/a 166n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310775
PNG
(US10150764, Compound 61)
Show SMILES CCCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1
PDB
MMDB

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n/an/a 188n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310776
PNG
(US10150764, Compound 62)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OC)c1)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)nc2OC)c1C
Show InChI InChI=1S/C33H46ClN5O3/c1-8-38(27-15-13-26(14-16-27)37(5)21-24-11-10-12-28(17-24)41-6)31-19-25(34)18-29(22(31)3)32(40)35-20-30-23(4)39(9-2)36-33(30)42-7/h10-12,17-19,26-27H,8-9,13-16,20-21H2,1-7H3,(H,35,40)/t26-,27-
PDB
MMDB

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n/an/a 193n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310769
PNG
(US10150764, Compound 54)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1
PDB

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n/an/a 194n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310749
PNG
(US10150764, Compound 34)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C
PDB

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n/an/a 223n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310744
PNG
(US10150764, Compound 31a)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2cn(C)[nH]c2=O)c1C
PDB
MMDB

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n/an/a 230n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310801
PNG
(US10150764, Compound 87)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)n(C)c2=O)c1C
Show InChI InChI=1S/C25H38ClN5O2/c1-8-31(20-11-9-19(10-12-20)28(4)5)23-14-18(26)13-21(16(23)2)24(32)27-15-22-17(3)29(6)30(7)25(22)33/h13-14,19-20H,8-12,15H2,1-7H3,(H,27,32)/t19-,20-
PDB
MMDB

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n/an/a 253n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310753
PNG
(US10150764, Compound 38)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(CC)[nH]n(C)c2=O)c1C
PDB
MMDB

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n/an/a 265n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310750
PNG
(US10150764, Compound 35)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C)-c1ccc(OCCOC)cc1
PDB

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n/an/a 267n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310781
PNG
(US10150764, Compound 67 | US10150764, Compound 73)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccnc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C
PDB

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n/an/a 319n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310801
PNG
(US10150764, Compound 87)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)n(C)c2=O)c1C
Show InChI InChI=1S/C25H38ClN5O2/c1-8-31(20-11-9-19(10-12-20)28(4)5)23-14-18(26)13-21(16(23)2)24(32)27-15-22-17(3)29(6)30(7)25(22)33/h13-14,19-20H,8-12,15H2,1-7H3,(H,27,32)/t19-,20-
PDB

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n/an/a 335n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310773
PNG
(US10150764, Compound 58)
Show SMILES CCCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C)-c1ccc(OCCOC)cc1
PDB
MMDB

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n/an/a 342n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310762
PNG
(US10150764, Compound 47)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C)-c1ccc(nc1)N1CCNCC1
PDB

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n/an/a 348n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310767
PNG
(US10150764, Compound 52)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)[nH]c2=O)c1C
PDB

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n/an/a 367n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310762
PNG
(US10150764, Compound 47)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C)-c1ccc(nc1)N1CCNCC1
PDB
MMDB

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n/an/a 382n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310770
PNG
(US10150764, Compound 55)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)CCOC)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C
PDB
MMDB

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n/an/a 418n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310779
PNG
(US10150764, Compound 65)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)CCOC)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)[nH]c2=O)c1C
PDB
MMDB

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n/an/a 442n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310748
PNG
(US10150764, Compound 33b)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C
PDB
MMDB

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n/an/a 479n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310793
PNG
(US10150764, Compound 79)
Show SMILES CCN(C1CCN(CCc2cccc(OC)c2)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C
PDB

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n/an/a 485n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310804
PNG
(US10150764, Compound 90)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(n(C)n(C)c2=O)C(F)(F)F)c1C
Show InChI InChI=1S/C25H35ClF3N5O2/c1-7-34(18-10-8-17(9-11-18)31(3)4)21-13-16(26)12-19(15(21)2)23(35)30-14-20-22(25(27,28)29)32(5)33(6)24(20)36/h12-13,17-18H,7-11,14H2,1-6H3,(H,30,35)/t17-,18-
PDB
MMDB

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US Patent
n/an/a 502n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310785
PNG
(US10150764, Compound 71)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1ccc(OC)cc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)[nH]c2=O)c1C
PDB
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n/an/a 504n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310744
PNG
(US10150764, Compound 31a)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2cn(C)[nH]c2=O)c1C
PDB

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n/an/a 505n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310766
PNG
(US10150764, Compound 51)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c3ncccn3[nH]c2=O)c1C
PDB
MMDB

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n/an/a 573n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310768
PNG
(US10150764, Compound 53)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(OC)nn(C)c2C)c1C)-c1ccc(CN2CCOCC2)cc1
Show InChI InChI=1S/C36H52N6O3/c1-8-42(31-15-13-30(14-16-31)39(4)5)34-22-29(28-11-9-27(10-12-28)24-41-17-19-45-20-18-41)21-32(25(34)2)35(43)37-23-33-26(3)40(6)38-36(33)44-7/h9-12,21-22,30-31H,8,13-20,23-24H2,1-7H3,(H,37,43)/t30-,31-
PDB
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n/an/a 625n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310761
PNG
(US10150764, Compound 46)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C)-c1ccc(CN2CCOCC2)cc1
PDB
MMDB

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n/an/a 682n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310755
PNG
(US10150764, Compound 40)
Show SMILES CCCCc1[nH]n(C)c(=O)c1CNC(=O)c1cc(Cl)cc(N(CC)[C@H]2CC[C@@H](CC2)N(C)C)c1C
PDB

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n/an/a 689n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310774
PNG
(US10150764, Compound 60)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)CCOC)c1cc(cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C)-c1ccc(OCCOC)cc1
PDB
MMDB

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n/an/a 695n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310770
PNG
(US10150764, Compound 55)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)CCOC)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C
PDB

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n/an/a 695n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310776
PNG
(US10150764, Compound 62)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OC)c1)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)nc2OC)c1C
Show InChI InChI=1S/C33H46ClN5O3/c1-8-38(27-15-13-26(14-16-27)37(5)21-24-11-10-12-28(17-24)41-6)31-19-25(34)18-29(22(31)3)32(40)35-20-30-23(4)39(9-2)36-33(30)42-7/h10-12,17-19,26-27H,8-9,13-16,20-21H2,1-7H3,(H,35,40)/t26-,27-
PDB

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n/an/a 745n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310751
PNG
(US10150764, Compound 36)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(CC)c2=O)c1C
PDB

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n/an/a 829n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310775
PNG
(US10150764, Compound 61)
Show SMILES CCCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C)-c1ccc(CN2CCOCC2)cc1
PDB

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n/an/a 857n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310748
PNG
(US10150764, Compound 33b)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C
PDB

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n/an/a 975n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310745
PNG
(US10150764, Compound 31b)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(SC)n(C)[nH]c2=O)c1C
PDB
MMDB

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n/an/a 1.07E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310779
PNG
(US10150764, Compound 65)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)CCOC)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)[nH]c2=O)c1C
PDB

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n/an/a 1.14E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310805
PNG
(US10150764, Compound 91)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)nn(C)c2OC)c1C
Show InChI InChI=1S/C25H38ClN5O2/c1-8-31(20-11-9-19(10-12-20)29(4)5)23-14-18(26)13-21(16(23)2)24(32)27-15-22-17(3)28-30(6)25(22)33-7/h13-14,19-20H,8-12,15H2,1-7H3,(H,27,32)/t19-,20-
PDB
MMDB

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n/an/a 1.17E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310798
PNG
(US10150764, Compound 84)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OC)c1)c1cc(Cl)cc(C(=O)NCc2c(N3CCCCC3)n(C)[nH]c2=O)c1C
PDB
MMDB

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n/an/a 1.22E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310745
PNG
(US10150764, Compound 31b)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(SC)n(C)[nH]c2=O)c1C
PDB

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n/an/a 1.24E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310781
PNG
(US10150764, Compound 67 | US10150764, Compound 73)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccnc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C
PDB

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n/an/a 1.29E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310798
PNG
(US10150764, Compound 84)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OC)c1)c1cc(Cl)cc(C(=O)NCc2c(N3CCCCC3)n(C)[nH]c2=O)c1C
PDB

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n/an/a 1.44E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310773
PNG
(US10150764, Compound 58)
Show SMILES CCCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C)-c1ccc(OCCOC)cc1
PDB

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n/an/a 1.54E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310804
PNG
(US10150764, Compound 90)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(n(C)n(C)c2=O)C(F)(F)F)c1C
Show InChI InChI=1S/C25H35ClF3N5O2/c1-7-34(18-10-8-17(9-11-18)31(3)4)21-13-16(26)12-19(15(21)2)23(35)30-14-20-22(25(27,28)29)32(5)33(6)24(20)36/h12-13,17-18H,7-11,14H2,1-6H3,(H,30,35)/t17-,18-
PDB

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n/an/a 1.91E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310785
PNG
(US10150764, Compound 71)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1ccc(OC)cc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)[nH]c2=O)c1C
PDB

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n/an/a 1.92E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310774
PNG
(US10150764, Compound 60)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)CCOC)c1cc(cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C)-c1ccc(OCCOC)cc1
PDB

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n/an/a 2.11E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310768
PNG
(US10150764, Compound 53)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(cc(C(=O)NCc2c(OC)nn(C)c2C)c1C)-c1ccc(CN2CCOCC2)cc1
Show InChI InChI=1S/C36H52N6O3/c1-8-42(31-15-13-30(14-16-31)39(4)5)34-22-29(28-11-9-27(10-12-28)24-41-17-19-45-20-18-41)21-32(25(34)2)35(43)37-23-33-26(3)40(6)38-36(33)44-7/h9-12,21-22,30-31H,8,13-20,23-24H2,1-7H3,(H,37,43)/t30-,31-
PDB

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n/an/a 2.18E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310754
PNG
(US10150764, Compound 39)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c([nH]n(C)c2=O)C(C)C)c1C
PDB
MMDB

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US Patent
n/an/a 2.23E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310780
PNG
(US10150764, Compound 66)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccnc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)nc2OC)c1C
Show InChI InChI=1S/C30H41ClN6O2/c1-7-37(25-12-10-24(11-13-25)35(4)19-22-9-8-14-32-17-22)28-16-23(31)15-26(20(28)2)29(38)33-18-27-21(3)36(5)34-30(27)39-6/h8-9,14-17,24-25H,7,10-13,18-19H2,1-6H3,(H,33,38)/t24-,25-
PDB
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UniChem
US Patent
n/an/a 2.34E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310782
PNG
(US10150764, Compound 68)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OCCOC)c1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)nc2OC)c1C
Show InChI InChI=1S/C34H48ClN5O4/c1-8-40(28-14-12-27(13-15-28)38(4)22-25-10-9-11-29(18-25)44-17-16-42-6)32-20-26(35)19-30(23(32)2)33(41)36-21-31-24(3)39(5)37-34(31)43-7/h9-11,18-20,27-28H,8,12-17,21-22H2,1-7H3,(H,36,41)/t27-,28-
PDB

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US Patent
n/an/a 2.59E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310752
PNG
(US10150764, Compound 37)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(C(C)C)c2=O)c1C
PDB
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US Patent
n/an/a 2.67E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310765
PNG
(US10150764, Compound 50)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)nn3cccnc23)c1C
Show InChI InChI=1S/C26H35ClN6O2/c1-6-32(20-10-8-19(9-11-20)31(3)4)23-15-18(27)14-21(17(23)2)25(34)29-16-22-24-28-12-7-13-33(24)30-26(22)35-5/h7,12-15,19-20H,6,8-11,16H2,1-5H3,(H,29,34)/t19-,20-
PDB
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US Patent
n/an/a 2.71E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310766
PNG
(US10150764, Compound 51)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c3ncccn3[nH]c2=O)c1C
PDB

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US Patent
n/an/a 2.87E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310761
PNG
(US10150764, Compound 46)
Show SMILES CCN(C1CCOCC1)c1cc(cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C)-c1ccc(CN2CCOCC2)cc1
PDB

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US Patent
n/an/a 3.25E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310753
PNG
(US10150764, Compound 38)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(CC)[nH]n(C)c2=O)c1C
PDB

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US Patent
n/an/a 3.37E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310792
PNG
(US10150764, Compound 78)
Show SMILES CCN(C1CCN(CCc2cccc(OC)c2)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)nc2OC)c1C
Show InChI InChI=1S/C31H42ClN5O3/c1-7-37(25-12-15-36(16-13-25)14-11-23-9-8-10-26(17-23)39-5)29-19-24(32)18-27(21(29)2)30(38)33-20-28-22(3)35(4)34-31(28)40-6/h8-10,17-19,25H,7,11-16,20H2,1-6H3,(H,33,38)
PDB
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US Patent
n/an/a 4.27E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310778
PNG
(US10150764, Compound 64)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)CCOC)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)nc2OC)c1C
Show InChI InChI=1S/C28H44ClN5O3/c1-8-33(23-12-10-22(11-13-23)32(5)14-15-36-6)26-17-21(29)16-24(19(26)3)27(35)30-18-25-20(4)34(9-2)31-28(25)37-7/h16-17,22-23H,8-15,18H2,1-7H3,(H,30,35)/t22-,23-
PDB
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n/an/a 4.48E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310791
PNG
(US10150764, Compound 77)
Show SMILES CCN(C1CCN(CCOC)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C
PDB
MMDB

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US Patent
n/an/a 4.69E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310764
PNG
(US10150764, Compound 49)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c3nc(C)cc(C)n3[nH]c2=O)c1C
PDB
MMDB

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US Patent
n/an/a 5.17E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310786
PNG
(US10150764, Compound 72)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C(C)c1cccnc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)nc2OC)c1C
Show InChI InChI=1S/C31H43ClN6O2/c1-8-38(26-13-11-25(12-14-26)36(5)21(3)23-10-9-15-33-18-23)29-17-24(32)16-27(20(29)2)30(39)34-19-28-22(4)37(6)35-31(28)40-7/h9-10,15-18,21,25-26H,8,11-14,19H2,1-7H3,(H,34,39)/t21?,25-,26-
PDB
MMDB

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US Patent
n/an/a 5.68E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310741
PNG
(US10150764, Compound 8)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)nc3cc[nH]n3c2=O)c1C
PDB
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n/an/a 5.82E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310754
PNG
(US10150764, Compound 39)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c([nH]n(C)c2=O)C(C)C)c1C
PDB

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n/an/a 6.58E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310788
PNG
(US10150764, Compound 74)
Show SMILES CCN(C1CCN(CCOC)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)nc2OC)c1C
Show InChI InChI=1S/C26H40ClN5O3/c1-7-31(21-9-11-30(12-10-21)13-14-34-5)24-16-20(27)15-22(18(24)3)25(33)28-17-23-19(4)32(8-2)29-26(23)35-6/h15-16,21H,7-14,17H2,1-6H3,(H,28,33)
PDB
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US Patent
n/an/a 7.25E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310805
PNG
(US10150764, Compound 91)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)nn(C)c2OC)c1C
Show InChI InChI=1S/C25H38ClN5O2/c1-8-31(20-11-9-19(10-12-20)29(4)5)23-14-18(26)13-21(16(23)2)24(32)27-15-22-17(3)28-30(6)25(22)33-7/h13-14,19-20H,8-12,15H2,1-7H3,(H,27,32)/t19-,20-
PDB

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n/an/a 7.45E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310799
PNG
(US10150764, Compound 85)
Show SMILES CCOc1n[nH]c(C)c1CNC(=O)c1cc(Cl)cc(N(CC)[C@H]2CC[C@@H](CC2)N(C)C)c1C
PDB
MMDB

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US Patent
n/an/a 7.53E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310740
PNG
(US10150764, Compound 2)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)cc3cc[nH]n3c2=O)c1C
PDB
MMDB

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US Patent
n/an/a 8.35E+3n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310780
PNG
(US10150764, Compound 66)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccnc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)nc2OC)c1C
Show InChI InChI=1S/C30H41ClN6O2/c1-7-37(25-12-10-24(11-13-25)35(4)19-22-9-8-14-32-17-22)28-16-23(31)15-26(20(28)2)29(38)33-18-27-21(3)36(5)34-30(27)39-6/h8-9,14-17,24-25H,7,10-13,18-19H2,1-6H3,(H,33,38)/t24-,25-
PDB

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n/an/a 1.03E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310764
PNG
(US10150764, Compound 49)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c3nc(C)cc(C)n3[nH]c2=O)c1C
PDB

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n/an/a 1.04E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310742
PNG
(US10150764, Compound 9)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)cc3nc(C)[nH]n3c2=O)c1C
PDB
MMDB

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n/an/a 1.15E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310788
PNG
(US10150764, Compound 74)
Show SMILES CCN(C1CCN(CCOC)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)nc2OC)c1C
Show InChI InChI=1S/C26H40ClN5O3/c1-7-31(21-9-11-30(12-10-21)13-14-34-5)24-16-20(27)15-22(18(24)3)25(33)28-17-23-19(4)32(8-2)29-26(23)35-6/h15-16,21H,7-14,17H2,1-6H3,(H,28,33)
PDB

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n/an/a 1.26E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310791
PNG
(US10150764, Compound 77)
Show SMILES CCN(C1CCN(CCOC)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)[nH]c2=O)c1C
PDB

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n/an/a 1.26E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310740
PNG
(US10150764, Compound 2)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)cc3cc[nH]n3c2=O)c1C
PDB

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UniChem
US Patent
n/an/a 1.51E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310752
PNG
(US10150764, Compound 37)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(C(C)C)c2=O)c1C
PDB

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UniChem
US Patent
n/an/a 1.56E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310778
PNG
(US10150764, Compound 64)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)CCOC)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)nc2OC)c1C
Show InChI InChI=1S/C28H44ClN5O3/c1-8-33(23-12-10-22(11-13-23)32(5)14-15-36-6)26-17-21(29)16-24(19(26)3)27(35)30-18-25-20(4)34(9-2)31-28(25)37-7/h16-17,22-23H,8-15,18H2,1-7H3,(H,30,35)/t22-,23-
PDB

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US Patent
n/an/a 1.75E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310792
PNG
(US10150764, Compound 78)
Show SMILES CCN(C1CCN(CCc2cccc(OC)c2)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)nc2OC)c1C
Show InChI InChI=1S/C31H42ClN5O3/c1-7-37(25-12-15-36(16-13-25)14-11-23-9-8-10-26(17-23)39-5)29-19-24(32)18-27(21(29)2)30(38)33-20-28-22(3)35(4)34-31(28)40-6/h8-10,17-19,25H,7,11-16,20H2,1-6H3,(H,33,38)
PDB

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US Patent
n/an/a 1.76E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310809
PNG
(US10150764, Compound 95)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)nn(C)c2OC)c1C
Show InChI InChI=1S/C25H38ClN5O3/c1-8-31(19-11-9-18(10-12-19)29(3)4)22-14-17(26)13-20(16(22)2)23(32)27-15-21-24(33-6)28-30(5)25(21)34-7/h13-14,18-19H,8-12,15H2,1-7H3,(H,27,32)/t18-,19-
PDB
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n/an/a 1.77E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310797
PNG
(US10150764, Compound 83)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OC)c1)c1cc(Cl)cc(C(=O)NCc2c(OC)nn(C)c2N2CCCCC2)c1C
Show InChI InChI=1S/C36H51ClN6O3/c1-7-43(29-16-14-28(15-17-29)40(3)24-26-12-11-13-30(20-26)45-5)33-22-27(37)21-31(25(33)2)34(44)38-23-32-35(46-6)39-41(4)36(32)42-18-9-8-10-19-42/h11-13,20-22,28-29H,7-10,14-19,23-24H2,1-6H3,(H,38,44)/t28-,29-
PDB
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US Patent
n/an/a 1.83E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310741
PNG
(US10150764, Compound 8)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)nc3cc[nH]n3c2=O)c1C
PDB

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n/an/a 2.00E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310796
PNG
(US10150764, Compound 82)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)nn(C)c2N2CCOCC2)c1C
Show InChI InChI=1S/C28H43ClN6O3/c1-7-35(22-10-8-21(9-11-22)32(3)4)25-17-20(29)16-23(19(25)2)26(36)30-18-24-27(37-6)31-33(5)28(24)34-12-14-38-15-13-34/h16-17,21-22H,7-15,18H2,1-6H3,(H,30,36)/t21-,22-
PDB

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n/an/a 2.29E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310756
PNG
(US10150764, Compound 41)
Show SMILES CCN([C@@H]1COC[C@H]1O)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C
PDB
MMDB

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US Patent
n/an/a 2.62E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310796
PNG
(US10150764, Compound 82)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)nn(C)c2N2CCOCC2)c1C
Show InChI InChI=1S/C28H43ClN6O3/c1-7-35(22-10-8-21(9-11-22)32(3)4)25-17-20(29)16-23(19(25)2)26(36)30-18-24-27(37-6)31-33(5)28(24)34-12-14-38-15-13-34/h16-17,21-22H,7-15,18H2,1-6H3,(H,30,36)/t21-,22-
PDB
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n/an/a 2.70E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310765
PNG
(US10150764, Compound 50)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)nn3cccnc23)c1C
Show InChI InChI=1S/C26H35ClN6O2/c1-6-32(20-10-8-19(9-11-20)31(3)4)23-15-18(27)14-21(17(23)2)25(34)29-16-22-24-28-12-7-13-33(24)30-26(22)35-5/h7,12-15,19-20H,6,8-11,16H2,1-5H3,(H,29,34)/t19-,20-
PDB

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n/an/a 2.76E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310742
PNG
(US10150764, Compound 9)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(C)cc3nc(C)[nH]n3c2=O)c1C
PDB

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US Patent
n/an/a 3.45E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310799
PNG
(US10150764, Compound 85)
Show SMILES CCOc1n[nH]c(C)c1CNC(=O)c1cc(Cl)cc(N(CC)[C@H]2CC[C@@H](CC2)N(C)C)c1C
PDB

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n/an/a 3.52E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310756
PNG
(US10150764, Compound 41)
Show SMILES CCN([C@@H]1COC[C@H]1O)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C
PDB

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n/an/a 3.72E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310797
PNG
(US10150764, Compound 83)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)Cc1cccc(OC)c1)c1cc(Cl)cc(C(=O)NCc2c(OC)nn(C)c2N2CCCCC2)c1C
Show InChI InChI=1S/C36H51ClN6O3/c1-7-43(29-16-14-28(15-17-29)40(3)24-26-12-11-13-30(20-26)45-5)33-22-27(37)21-31(25(33)2)34(44)38-23-32-35(46-6)39-41(4)36(32)42-18-9-8-10-19-42/h11-13,20-22,28-29H,7-10,14-19,23-24H2,1-6H3,(H,38,44)/t28-,29-
PDB

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n/an/a 4.58E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310802
PNG
(US10150764, Compound 88)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)n(C)nc2C(F)(F)F)c1C
Show InChI InChI=1S/C25H35ClF3N5O2/c1-7-34(18-10-8-17(9-11-18)32(3)4)21-13-16(26)12-19(15(21)2)23(35)30-14-20-22(25(27,28)29)31-33(5)24(20)36-6/h12-13,17-18H,7-11,14H2,1-6H3,(H,30,35)/t17-,18-
PDB
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n/an/a 4.64E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310794
PNG
(US10150764, Compound 80)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)nn(C)c2N2CCCC2)c1C
Show InChI InChI=1S/C28H43ClN6O2/c1-7-35(22-12-10-21(11-13-22)32(3)4)25-17-20(29)16-23(19(25)2)26(36)30-18-24-27(37-6)31-33(5)28(24)34-14-8-9-15-34/h16-17,21-22H,7-15,18H2,1-6H3,(H,30,36)/t21-,22-
PDB
MMDB

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n/an/a 4.94E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310786
PNG
(US10150764, Compound 72)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C(C)c1cccnc1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)nc2OC)c1C
Show InChI InChI=1S/C31H43ClN6O2/c1-8-38(26-13-11-25(12-14-26)36(5)21(3)23-10-9-15-33-18-23)29-17-24(32)16-27(20(29)2)30(39)34-19-28-22(4)37(6)35-31(28)40-7/h9-10,15-18,21,25-26H,8,11-14,19H2,1-7H3,(H,34,39)/t21?,25-,26-
PDB

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n/an/a>5.00E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310790
PNG
(US10150764, Compound 76)
Show SMILES CCN(C1CCN(CCOC)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)nc2OC)c1C
Show InChI InChI=1S/C25H38ClN5O3/c1-7-31(20-8-10-30(11-9-20)12-13-33-5)23-15-19(26)14-21(17(23)2)24(32)27-16-22-18(3)29(4)28-25(22)34-6/h14-15,20H,7-13,16H2,1-6H3,(H,27,32)
PDB

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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310763
PNG
(US10150764, Compound 48)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)nn3c(C)cc(C)nc23)c1C
Show InChI InChI=1S/C28H39ClN6O2/c1-8-34(22-11-9-21(10-12-22)33(5)6)25-15-20(29)14-23(19(25)4)27(36)30-16-24-26-31-17(2)13-18(3)35(26)32-28(24)37-7/h13-15,21-22H,8-12,16H2,1-7H3,(H,30,36)/t21-,22-
PDB

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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310763
PNG
(US10150764, Compound 48)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)nn3c(C)cc(C)nc23)c1C
Show InChI InChI=1S/C28H39ClN6O2/c1-8-34(22-11-9-21(10-12-22)33(5)6)25-15-20(29)14-23(19(25)4)27(36)30-16-24-26-31-17(2)13-18(3)35(26)32-28(24)37-7/h13-15,21-22H,8-12,16H2,1-7H3,(H,30,36)/t21-,22-
PDB
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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310790
PNG
(US10150764, Compound 76)
Show SMILES CCN(C1CCN(CCOC)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)n(C)nc2OC)c1C
Show InChI InChI=1S/C25H38ClN5O3/c1-7-31(20-8-10-30(11-9-20)12-13-33-5)23-15-19(26)14-21(17(23)2)24(32)27-16-22-18(3)29(4)28-25(22)34-6/h14-15,20H,7-13,16H2,1-6H3,(H,27,32)
PDB
MMDB

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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310802
PNG
(US10150764, Compound 88)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)n(C)nc2C(F)(F)F)c1C
Show InChI InChI=1S/C25H35ClF3N5O2/c1-7-34(18-10-8-17(9-11-18)32(3)4)21-13-16(26)12-19(15(21)2)23(35)30-14-20-22(25(27,28)29)31-33(5)24(20)36-6/h12-13,17-18H,7-11,14H2,1-6H3,(H,30,35)/t17-,18-
PDB

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US Patent
n/an/a>5.00E+4n/an/an/an/an/an/a



Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310758
PNG
(US10150764, Compound 43)
Show SMILES CCO[C@@H]1COC[C@H]1N(CC)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C
PDB
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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310760
PNG
(US10150764, Compound 45)
Show SMILES CCN([C@@H]1COC[C@H]1OCCOC)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C
PDB
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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310789
PNG
(US10150764, Compound 75)
Show SMILES CCN(C1CCN(CCOC)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)[nH]c2=O)c1C
PDB

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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310789
PNG
(US10150764, Compound 75)
Show SMILES CCN(C1CCN(CCOC)CC1)c1cc(Cl)cc(C(=O)NCc2c(C)n(CC)[nH]c2=O)c1C
PDB
MMDB

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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310806
PNG
(US10150764, Compound 92)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)nn(C)c2N2CCCCC2)c1C
Show InChI InChI=1S/C29H45ClN6O2/c1-7-36(23-13-11-22(12-14-23)33(3)4)26-18-21(30)17-24(20(26)2)27(37)31-19-25-28(38-6)32-34(5)29(25)35-15-9-8-10-16-35/h17-18,22-23H,7-16,19H2,1-6H3,(H,31,37)/t22-,23-
PDB
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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310808
PNG
(US10150764, Compound 94)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(nn(C)c2OC)N2CCCCC2)c1C
Show InChI InChI=1S/C29H45ClN6O2/c1-7-36(23-13-11-22(12-14-23)33(3)4)26-18-21(30)17-24(20(26)2)28(37)31-19-25-27(32-34(5)29(25)38-6)35-15-9-8-10-16-35/h17-18,22-23H,7-16,19H2,1-6H3,(H,31,37)/t22-,23-
PDB
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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310809
PNG
(US10150764, Compound 95)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)nn(C)c2OC)c1C
Show InChI InChI=1S/C25H38ClN5O3/c1-8-31(19-11-9-18(10-12-19)29(3)4)22-14-17(26)13-20(16(22)2)23(32)27-15-21-24(33-6)28-30(5)25(21)34-7/h13-14,18-19H,8-12,15H2,1-7H3,(H,27,32)/t18-,19-
PDB

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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310758
PNG
(US10150764, Compound 43)
Show SMILES CCO[C@@H]1COC[C@H]1N(CC)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C
PDB

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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310759
PNG
(US10150764, Compound 44)
Show SMILES CCN([C@@H]1COC[C@H]1OCCOC)c1cc(Cl)cc(C(=O)NCc2c(C)nn(C)c2OC)c1C
Show InChI InChI=1S/C24H35ClN4O5/c1-7-29(21-13-33-14-22(21)34-9-8-31-5)20-11-17(25)10-18(15(20)2)23(30)26-12-19-16(3)27-28(4)24(19)32-6/h10-11,21-22H,7-9,12-14H2,1-6H3,(H,26,30)/t21-,22-/m1/s1
PDB

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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310760
PNG
(US10150764, Compound 45)
Show SMILES CCN([C@@H]1COC[C@H]1OCCOC)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C
PDB

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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310794
PNG
(US10150764, Compound 80)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)nn(C)c2N2CCCC2)c1C
Show InChI InChI=1S/C28H43ClN6O2/c1-7-35(22-12-10-21(11-13-22)32(3)4)25-17-20(29)16-23(19(25)2)26(36)30-18-24-27(37-6)31-33(5)28(24)34-14-8-9-15-34/h16-17,21-22H,7-15,18H2,1-6H3,(H,30,36)/t21-,22-
PDB

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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310806
PNG
(US10150764, Compound 92)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(OC)nn(C)c2N2CCCCC2)c1C
Show InChI InChI=1S/C29H45ClN6O2/c1-7-36(23-13-11-22(12-14-23)33(3)4)26-18-21(30)17-24(20(26)2)27(37)31-19-25-28(38-6)32-34(5)29(25)35-15-9-8-10-16-35/h17-18,22-23H,7-16,19H2,1-6H3,(H,31,37)/t22-,23-
PDB

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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310808
PNG
(US10150764, Compound 94)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c(nn(C)c2OC)N2CCCCC2)c1C
Show InChI InChI=1S/C29H45ClN6O2/c1-7-36(23-13-11-22(12-14-23)33(3)4)26-18-21(30)17-24(20(26)2)28(37)31-19-25-27(32-34(5)29(25)38-6)35-15-9-8-10-16-35/h17-18,22-23H,7-16,19H2,1-6H3,(H,31,37)/t22-,23-
PDB

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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens)
BDBM310803
PNG
(US10150764, Compound 89)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c([nH]n(C)c2=O)C(F)(F)F)c1C
PDB
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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310757
PNG
(US10150764, Compound 42)
Show SMILES CCN([C@@H]1COC[C@H]1OC)c1cc(Cl)cc(C(=O)NCc2c(C)[nH]n(C)c2=O)c1C
PDB

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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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


(Homo sapiens (Human))
BDBM310803
PNG
(US10150764, Compound 89)
Show SMILES CCN([C@H]1CC[C@@H](CC1)N(C)C)c1cc(Cl)cc(C(=O)NCc2c([nH]n(C)c2=O)C(F)(F)F)c1C
PDB

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Epizyme, Inc.

US Patent


Assay Description
The assays were performed in a buffer consisting of 20 mM bicine (pH=7.6), 0.5 mM DTT, 0.005% BSG, 100 mM KCl and 0.002% Tween20, prepared on the day...


US Patent US10150764 (2018)

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