| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L013141
BDB013141
|
US9580437, Example 139
Cc1nc(S(C)(=O)=O)ccc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cnnc12
|
C21H19FN6O3S 454.487000 |
DLZBXGWPXWPQBZ-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291824; PubChem:CID121432985
|
Local ready
Direct docking supported
|
|
E3L013142
BDB013142
|
US9580437, Example 140
CN(C)C(=O)c1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)cn1
|
C22H20FN7O2 433.447000 |
KBJMHUHSYLAULW-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291825; PubChem:CID121432986
|
Local ready
Direct docking supported
|
|
E3L013143
BDB013143
|
US9580437, Example 141
COc1ncccc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cnnc12
|
C20H17FN6O2 392.394000 |
WGSSGMBETWXQTP-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291826; PubChem:CID121432988
|
Local ready
Direct docking supported
|
|
E3L013144
BDB013144
|
US9580437, Example 142
COc1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)cn1
|
C20H17FN6O2 392.394000 |
FUNZVDGKJVAOOJ-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291827; PubChem:CID121433073
|
Local ready
Direct docking supported
|
|
E3L013145
BDB013145
|
US9580437, Example 143
CCn1nccc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cnnc12
|
C19H18FN7O 379.399000 |
UNLITPQSTNMSHD-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291828; PubChem:CID121433076
|
Local ready
Direct docking supported
|
|
E3L013146
BDB013146
|
US9580437, Example 144
CC(C)n1nccc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cnnc12
|
C20H20FN7O 393.426000 |
QUSVMVJIKBQQRZ-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291829; PubChem:CID121432976
|
Local ready
Direct docking supported
|
|
E3L013147
BDB013147
|
US9580437, Example 145
COc1cc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)ccn1
|
C20H17FN6O2 392.394000 |
KINCYOIHPUNFIT-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291830; PubChem:CID121432900
|
Local ready
Direct docking supported
|
|
E3L013148
BDB013148
|
US9580437, Example 146
Fc1ccc2c(c1CNc1ncc(-c3ccc(Cl)cc3Cl)c3nncn13)CCO2
|
C20H14Cl2FN5O 430.270000 |
AQXBBTSMVMTNQM-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291831; PubChem:CID121432853
|
Local ready
Direct docking supported
|
|
E3L013149
BDB013149
|
US9580437, Example 147
Cn1cc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)cn1
|
C18H16FN7O 365.372000 |
SAWHJBBSBAZMKT-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291832; PubChem:CID121432990
|
Local ready
Direct docking supported
|
|
E3L013150
BDB013150
|
US9580437, Example 148
CC(C)n1cc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)c(F)n1
|
C20H19F2N7O 411.416000 |
AZZMTUDPRNUAOO-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291833; PubChem:CID137528700
|
Local ready
Direct docking supported
|
|
E3L013151
BDB013151
|
US9580437, Example 149
c1cc(CNc2ncc(-c3cnn(C4CC4)c3)c3nncn23)c2c(c1)OCC2
|
C20H19N7O 373.420000 |
MGRDRQOHZLHNJD-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291834; PubChem:CID121432905
|
Local ready
Direct docking supported
|
|
E3L013152
BDB013152
|
US9580437, Example 150
Fc1ccc2c(c1CNc1ncc(-c3cnn(C4CC4)c3)c3nncn13)CCO2
|
C20H18FN7O 391.410000 |
FMPAEGNLXRPGNU-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291835; PubChem:CID121432995
|
Local ready
Direct docking supported
|
|
E3L013153
BDB013153
|
US9580437, Example 151
Cc1nn(C(C)C)c(C)c1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cnnc12
|
C22H24FN7O 421.480000 |
DJPYZFQNPFZTDU-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291836; PubChem:CID121432908
|
Local ready
Direct docking supported
|
|
E3L013154
BDB013154
|
US9580437, Example 152
Cn1nccc1-c1cnc(NCc2cccc3c2CCO3)n2cnnc12
|
C18H17N7O 347.382000 |
RSKOSZLBEDGTFX-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291837; PubChem:CID121432978
|
Local ready
Direct docking supported
|
|
E3L013155
BDB013155
|
US9580437, Example 153
Cc1nn(C(C)C)c(C)c1-c1cnc(NCc2cccc3c2CCO3)n2cnnc12
|
C22H25N7O 403.490000 |
CQQVPXGIZAZXEE-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291838; PubChem:CID121432854
|
Local ready
Direct docking supported
|
|
E3L013156
BDB013156
|
US9580437, Example 154
FC(F)c1ccc(-c2cnc(NCc3cccc4c3CCO4)n3cnnc23)cn1
|
C20H16F2N6O 394.385000 |
RMXULPQCLOPFHH-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291839; PubChem:CID121433075
|
Local ready
Direct docking supported
|
|
E3L013157
BDB013157
|
US9580437, Example 155
COc1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)c(C)n1
|
C21H19FN6O2 406.421000 |
PEOKWSYLZQBIAB-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291840; PubChem:CID121432998
|
Local ready
Direct docking supported
|
|
E3L013158
BDB013158
|
US9580437, Example 156
Cc1nc(N)ccc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cnnc12
|
C20H18FN7O 391.410000 |
BRUGMDDOWOCWCH-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291841; PubChem:CID121432981
|
Local ready
Direct docking supported
|
|
E3L013159
BDB013159
|
US9580437, Example 157
Fc1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)c(Cl)c1
|
C20H14ClF2N5O 413.815000 |
WLNBEPMWVGQFQH-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291842; PubChem:CID121433006
|
Local ready
Direct docking supported
|
|
E3L013160
BDB013160
|
US9580437, Example 158
Cc1nn(CCO)c(C)c1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cnnc12
|
C21H22FN7O2 423.452000 |
XAEZNFSFBSOYDY-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291843; PubChem:CID121433077
|
Local ready
Direct docking supported
|