| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L013201
BDB013201
|
US9580437, Example 200
Cn1cc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)c(C(F)F)n1
|
C19H16F3N7O 415.379000 |
KEILWHBZYZTFCA-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291885; PubChem:CID121433095
|
Local ready
Direct docking supported
|
|
E3L013202
BDB013202
|
US9580437, Example 201
Cc1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)c(C(F)F)n1
|
C21H17F3N6O 426.402000 |
VFTBGQMPOGKNNW-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291886; PubChem:CID121433101
|
Local ready
Direct docking supported
|
|
E3L013203
BDB013203
|
US9580437, Example 202
Fc1ccc2c(c1CNc1ncc(-c3ccnnc3)c3nncn13)CCO2
|
C18H14FN7O 363.356000 |
DTMBNYTZQHNAOL-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291887; PubChem:CID121433013
|
Local ready
Direct docking supported
|
|
E3L013204
BDB013204
|
US9580437, Example 203
Cc1ncccc1-c1c(C)nc(NCc2c(F)ccc3c2CCO3)n2cnnc12
|
C21H19FN6O 390.422000 |
KYFUPLQMKRWTEP-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291888; PubChem:CID121432914
|
Local ready
Direct docking supported
|
|
E3L013205
BDB013205
|
US9580437, Example 204
Cc1c(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)ccc[n+]1[O-]
|
C20H17FN6O2 392.394000 |
YJMBAIMXLQUONI-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291889; PubChem:CID137440470
|
Local ready
Direct docking supported
|
|
E3L013206
BDB013206
|
US9580437, Example 205
Fc1ccc2c(c1CNc1ncc(-c3cnccn3)c3nncn13)CCO2
|
C18H14FN7O 363.356000 |
DRPIQKNZCVRWMV-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291890; PubChem:CID121432915
|
Local ready
Direct docking supported
|
|
E3L013207
BDB013207
|
US9580437, Example 206
Fc1ccc2c(c1CNc1ncc(-c3cncnc3)c3nncn13)CCO2
|
C18H14FN7O 363.356000 |
ZRKQYFJHCJLPNU-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291891; PubChem:CID121432991
|
Local ready
Direct docking supported
|
|
E3L013208
BDB013208
|
BDBM291892
Cc1ncccc1-c1cnc(NCc2c(F)ccc3occc23)n2cnnc12
|
C20H15FN6O 374.379000 |
DTZWAJBMXDSNSI-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291892; PubChem:CID121412598
|
Local ready
Direct docking supported
|
|
E3L013209
BDB013209
|
US9580437, Example 208
CN(C)Cc1ccc(-c2cnc(NCc3cccc4occc34)n3cnnc23)cc1
|
C23H22N6O 398.470000 |
XWBFBLGYMZOMCW-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291893; PubChem:CID121433015
|
Local ready
Direct docking supported
|
|
E3L013210
BDB013210
|
US9580437, Example 209
CN1CCN(c2ccc(-c3cnc(NCc4cccc5occc45)n4cnnc34)cc2)CC1
|
C25H25N7O 439.523000 |
LJZKDYKZIDGGOG-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291894; PubChem:CID121433017
|
Local ready
Direct docking supported
|
|
E3L013211
BDB013211
|
US9580437, Example 210
CC(c1ccc(-c2cnc(NCc3cccc4occc34)n3cnnc23)cc1)N1CCCC1
|
C26H26N6O 438.535000 |
ZBNBGTVUPQTUCA-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291895; PubChem:CID121432896
|
Local ready
Direct docking supported
|
|
E3L013212
BDB013212
|
US9580437, Example 211
CN1CCN(c2ccc(-c3cnc(NCc4cccc5occc45)n4cnnc34)cn2)CC1
|
C24H24N8O 440.511000 |
YQWNSORSVYFCHQ-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291896; PubChem:CID121432916
|
Local ready
Direct docking supported
|
|
E3L013213
BDB013213
|
US9580437, Example 212
CN1CCN(c2cc(-c3cnc(NCc4cccc5occc45)n4cnnc34)ccn2)CC1
|
C24H24N8O 440.511000 |
PXMQJBGRPMXBMB-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291897; PubChem:CID121433018
|
Local ready
Direct docking supported
|
|
E3L013214
BDB013214
|
US9580437, Example 213
c1cncc(-c2cnc(NCc3cccc4occc34)n3cnnc23)c1
|
C19H14N6O 342.362000 |
JDURFLRZRIOZKA-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291898; PubChem:CID121433103
|
Local ready
Direct docking supported
|
|
E3L013215
BDB013215
|
US9580437, Example 214
CS(=O)(=O)c1ccc(-c2cnc(NCc3cccc4occc34)n3cnnc23)cc1
|
C21H17N5O3S 419.466000 |
ZCKREKXDGMDDHF-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291899; PubChem:CID121432897
|
Local ready
Direct docking supported
|
|
E3L013216
BDB013216
|
US9580437, Example 215
CC(C)S(=O)(=O)c1ccc(-c2cnc(NCc3cccc4occc34)n3cnnc23)cc1
|
C23H21N5O3S 447.520000 |
UQJILZDGBXJNJT-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291900; PubChem:CID121432997
|
Local ready
Direct docking supported
|
|
E3L013217
BDB013217
|
US9580437, Example 216
O=C(c1ccc(-c2cnc(NCc3cccc4occc34)n3cnnc23)cc1)N1CCCC1
|
C25H22N6O2 438.491000 |
TZZZJLSKOPRNFT-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291901; PubChem:CID121432999
|
Local ready
Direct docking supported
|
|
E3L013218
BDB013218
|
US9580437, Example 217
c1ccc(-c2cnc(NCc3cccc4occc34)n3cnnc23)cc1
|
C20H15N5O 341.374000 |
IZOARSUTSNEABS-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291902; PubChem:CID121433022
|
Local ready
Direct docking supported
|
|
E3L013219
BDB013219
|
US9580437, Example 218
c1cc(CNc2ncc(-c3ccncc3)c3nncn23)c2ccoc2c1
|
C19H14N6O 342.362000 |
ITXKZEROEOVKAH-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291903; PubChem:CID121433093
|
Local ready
Direct docking supported
|
|
E3L013220
BDB013220
|
US9580437, Example 219
CN(C)Cc1ccc(-c2cnc(NCc3c(F)ccc4occc34)n3cnnc23)cc1
|
C23H21FN6O 416.460000 |
WLVXOPOWSHFTFD-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291904; PubChem:CID121433105
|
Local ready
Direct docking supported
|