| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L012101
BDB012101
|
BDBM259347
Cc1cc(C)c(CNC(=O)c2csc(C3CCN(C(=O)OC(C)(C)C)C3)c2C)c(=O)[nH]1
|
C23H31N3O4S 445.585000 |
WEWBQPFPCRBHDO-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM259347; PubChem:CID86763479
|
Local ready
Direct docking supported
|
|
E3L012102
BDB012102
|
BDBM259348
Cc1cc(C)c(CNC(=O)c2csc(N3CCCC3C)c2C)c(=O)[nH]1
|
C19H25N3O2S 359.495000 |
HREMAGBXPZHMJC-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM259348; PubChem:CID86763480
|
Local ready
Direct docking supported
|
|
E3L012103
BDB012103
|
BDBM259349
Cc1cc(C)c(CNC(=O)c2csc(C(C)N3CCOCC3)c2C)c(=O)[nH]1
|
C20H27N3O3S 389.521000 |
RMFDEPMDYYFJQT-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM259349; PubChem:CID86763481
|
Local ready
Direct docking supported
|
|
E3L012104
BDB012104
|
BDBM259350
Cc1cc(C)c(CNC(=O)c2csc(C(C)N3CCC(N(C)C)CC3)c2C)c(=O)[nH]1
|
C23H34N4O2S 430.618000 |
OCVFHWCDYDBBRP-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM259350; PubChem:CID86763482
|
Local ready
Direct docking supported
|
|
E3L012105
BDB012105
|
BDBM259351
CCC(c1scc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)N1CCC(N(C)C)CC1
|
C24H36N4O2S 444.645000 |
LVGCTQDARMZPSW-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM259351; PubChem:CID86763593
|
Local ready
Direct docking supported
|
|
E3L012106
BDB012106
|
BDBM259352
CCC(c1scc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)N1CCOCC1
|
C21H29N3O3S 403.548000 |
HCZPNALPIXSQEE-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM259352; PubChem:CID86763594
|
Local ready
Direct docking supported
|
|
E3L012107
BDB012107
|
BDBM259353
CCN(c1ccc(C(=O)NCc2c(C)cc(C)[nH]c2=O)s1)C1CCOCC1
|
C20H27N3O3S 389.521000 |
IRGJOGXZRMFBTE-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM259353; PubChem:CID86763595
|
Local ready
Direct docking supported
|
|
E3L012108
BDB012108
|
BDBM259354
CCN(c1scc(C(=O)NCc2c(C)cc(C)n(C)c2=O)c1C)C1CCOCC1
|
C22H31N3O3S 417.575000 |
VSNXIWYGHMHREB-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM259354; PubChem:CID86763596
|
Local ready
Direct docking supported
|
|
E3L012109
BDB012109
|
BDBM259355
CCN(c1scc(C(=O)NCc2c(C)cc(C)n(C)c2=O)c1C)[C@H]1CC[C@H](N(C)C)CC1
|
C25H38N4O2S 458.672000 |
NDBUKNNBIYZRRW-MXVIHJGJSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB
BindingDB:BDBM259355
|
Local ready
Direct docking supported
|
|
E3L012110
BDB012110
|
BDBM259356
C/C=C(/c1scc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCNCC1
|
C22H29N3O2S 399.560000 |
KVWSOQMUSXAHGJ-YAXRCOADSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM259356; PubChem:CID86763598
|
Local ready
Direct docking supported
|
|
E3L012111
BDB012111
|
BDBM259357
C/C=C(/c1scc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1
|
C28H39N3O4S 513.704000 |
ZOZZQJIESSTKJX-OIOUFDJBSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB
BindingDB:BDBM259357
|
Local ready
Direct docking supported
|
|
E3L012112
BDB012112
|
BDBM259358
C/C=C(/c1scc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)[C@H]1CC[C@H](N)CC1
|
C23H31N3O2S 413.587000 |
JMYOSDLLACUDBE-FGPMGWODSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB
BindingDB:BDBM259358
|
Local ready
Direct docking supported
|
|
E3L012113
BDB012113
|
BDBM259359
C/C=C(/c1scc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)[C@H]1CC[C@H](N(C)C)CC1
|
C25H35N3O2S 441.641000 |
XCDDMQLPMMUTOY-NZDXKKTCSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB
BindingDB:BDBM259359
|
Local ready
Direct docking supported
|
|
E3L012114
BDB012114
|
BDBM259360
Cc1cc(C)c(CNC(=O)c2csc(C(O)[C@H]3CC[C@H](N)CC3)c2C)c(=O)[nH]1
|
C21H29N3O3S 403.548000 |
SELHOZRPYAMUKI-OSPTYYIOSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB
BindingDB:BDBM259360
|
Local ready
Direct docking supported
|
|
E3L012115
BDB012115
|
BDBM259361
Cc1cc(C)c(CNC(=O)c2csc(C(O)[C@H]3CC[C@H](N(C)C)CC3)c2C)c(=O)[nH]1
|
C23H33N3O3S 431.602000 |
LLXDKFMURVBHJV-IWZNKUOBSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB
BindingDB:BDBM259361
|
Local ready
Direct docking supported
|
|
E3L012116
BDB012116
|
BDBM259362
CCC(c1scc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCN(C(=O)OC(C)(C)C)CC1
|
C27H39N3O4S 501.693000 |
ISUJAGQKWSTODG-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM259362; PubChem:CID86763708
|
Local ready
Direct docking supported
|
|
E3L012117
BDB012117
|
BDBM259363
CCC(c1scc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCNCC1
|
C22H31N3O2S 401.576000 |
PJCORCKTZOPQIB-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM259363; PubChem:CID86763709
|
Local ready
Direct docking supported
|
|
E3L012118
BDB012118
|
BDBM259364
CC[C@@H](c1scc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)N1CCC(N(C)C)CC1
|
C24H36N4O2S 444.645000 |
LVGCTQDARMZPSW-NRFANRHFSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM259364; PubChem:CID86763815
|
Local ready
Direct docking supported
|
|
E3L012119
BDB012119
|
BDBM259365
CC[C@H](c1scc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)N1CCC(N(C)C)CC1
|
C24H36N4O2S 444.645000 |
LVGCTQDARMZPSW-OAQYLSRUSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM259365; PubChem:CID86763816
|
Local ready
Direct docking supported
|
|
E3L012120
BDB012120
|
BDBM259366
CCC(c1scc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)[C@H]1CC[C@H](N)CC1
|
C23H33N3O2S 415.603000 |
LQRSUXVZQNCRKZ-JHJOSGQCSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB
BindingDB:BDBM259366
|
Local ready
Direct docking supported
|