| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L021361
BDB021361
|
US11091495, Example 204
N#Cc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3ccc(C4CCCN4)cc3)c2n1
|
C26H23FN6O 454.509000 |
QFQOFKFJTAQQHV-UHFFFAOYSA-N | O75530, Q09028 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM513843; PubChem:CID155788129
|
Local ready
Direct docking supported
|
|
E3L021362
BDB021362
|
US11091495, Example 205
N#Cc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3ccc4c(c3)CNC4)c2n1
|
C24H19FN6O 426.455000 |
WCMWUOKIGJJBEW-UHFFFAOYSA-N | O75530, Q09028 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM513844; PubChem:CID155788050
|
Local ready
Direct docking supported
|
|
E3L021363
BDB021363
|
BDBM513845
COCCOc1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cc(C#N)nc23)c(C)c1
|
C26H24FN5O3 473.508000 |
DUXYHMYBFJIRAW-UHFFFAOYSA-N | O75530, Q09028 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM513845; PubChem:CID139371008
|
Local ready
Direct docking supported
|
|
E3L021364
BDB021364
|
BDBM513846
Cc1cc(CN(C)C)ccc1-c1cnc(NCc2c(F)ccc3c2C(O)CO3)n2cc(C#N)nc12
|
C26H25FN6O2 472.524000 |
MIACXTOAOOEYRF-UHFFFAOYSA-N | O75530, Q09028 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM513846; PubChem:CID155676910
|
Local ready
Direct docking supported
|
|
E3L021365
BDB021365
|
BDBM513847
CNC(=O)c1cc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cc(C#N)nc23)n(C)n1
|
C22H19FN8O2 446.446000 |
PUUDAUWNSZGWMD-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM513847; PubChem:CID155676987
|
Local ready
Direct docking supported
|
|
E3L021366
BDB021366
|
BDBM513848
CN(C)Cc1cc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cc(C#N)nc23)n(C)n1
|
C23H23FN8O 446.490000 |
WDAFAPSQJVMAAM-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM513848; PubChem:CID155676982
|
Local ready
Direct docking supported
|
|
E3L021367
BDB021367
|
BDBM513850
Cn1nc(C#N)cc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cc(C#N)nc12
|
C21H15FN8O 414.404000 |
KHCUUJBQMHEFFX-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM513850; PubChem:CID139371713
|
Local ready
Direct docking supported
|
|
E3L021368
BDB021368
|
US11091495, Example 213
Cc1cc([C@@H]2CCCN2)ccc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cc(C#N)nc12
|
C27H25FN6O 468.536000 |
QKETUAWXXUWCHE-DEOSSOPVSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM513851; PubChem:CID156050907
|
Local ready
Direct docking supported
|
|
E3L021369
BDB021369
|
US11091495, Example 214
Cc1cc([C@H]2CCCN2)ccc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cc(C#N)nc12
|
C27H25FN6O 468.536000 |
QKETUAWXXUWCHE-XMMPIXPASA-N | O75530, Q09028 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM513852; PubChem:CID156051058
|
Local ready
Direct docking supported
|
|
E3L021370
BDB021370
|
BDBM513853
N#Cc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3ccc(C(=O)O)nc3)c2n1
|
C22H15FN6O3 430.399000 |
VMPDLFKFCKRYRQ-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM513853; PubChem:CID155676938
|
Local ready
Direct docking supported
|
|
E3L021371
BDB021371
|
BDBM513854
CN(C)Cc1ncc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cc(C#N)nc23)cn1
|
C23H21FN8O 444.474000 |
OGGJAWYOWLHRHX-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM513854; PubChem:CID139371000
|
Local ready
Direct docking supported
|
|
E3L021372
BDB021372
|
BDBM513855
CN(C)CCc1cccc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cc(C#N)nc23)c1
|
C26H25FN6O 456.525000 |
FJGUSPHJPZYYAJ-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM513855; PubChem:CID139370710
|
Local ready
Direct docking supported
|
|
E3L021373
BDB021373
|
BDBM513856
N#Cc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3cc[nH]c(=O)c3)c2n1
|
C21H15FN6O2 402.389000 |
JIBDHSHJRVFEIW-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM513856; PubChem:CID150681933
|
Local ready
Direct docking supported
|
|
E3L021374
BDB021374
|
US11091495, Example 219
N#Cc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3ccc([C@@H]4CCCN4)cc3)c2n1
|
C26H23FN6O 454.509000 |
QFQOFKFJTAQQHV-QHCPKHFHSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM513857; PubChem:CID155788156
|
Local ready
Direct docking supported
|
|
E3L021375
BDB021375
|
US11091495, Example 220
N#Cc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3ccc([C@H]4CCCN4)cc3)c2n1
|
C26H23FN6O 454.509000 |
QFQOFKFJTAQQHV-HSZRJFAPSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM513858; PubChem:CID155788055
|
Local ready
Direct docking supported
|
|
E3L021376
BDB021376
|
US11091495, Example 221
CN1CCC1c1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cc(C#N)nc23)cc1
|
C26H23FN6O 454.509000 |
BVFSKJWAVRMYSH-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM513859; PubChem:CID155788157
|
Local ready
Direct docking supported
|
|
E3L021377
BDB021377
|
US11091495, Example 222
N#Cc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3ccc(C4CC(=O)N4)cc3)c2n1
|
C25H19FN6O2 454.465000 |
DYDXHJYZMKNYFZ-UHFFFAOYSA-N | O75530, Q09028 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM513860; PubChem:CID155788016
|
Local ready
Direct docking supported
|
|
E3L021378
BDB021378
|
US11091495, Example 224
Cn1cc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cc(C#N)nc23)c(C#N)n1
|
C21H15FN8O 414.404000 |
DAVDIQRPWGWPFS-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM513862; PubChem:CID156050909
|
Local ready
Direct docking supported
|
|
E3L021379
BDB021379
|
US11091495, Example 225
N#Cc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3ccc(C4COCCN4)cc3)c2n1
|
C26H23FN6O2 470.508000 |
RQXKTZWMEAIRMB-UHFFFAOYSA-N | O75530, Q09028 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM513863; PubChem:CID155788146
|
Local ready
Direct docking supported
|
|
E3L021380
BDB021380
|
US11091495, Example 226
N#Cc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3ccc(C4CCN4)cc3)c2n1
|
C25H21FN6O 440.482000 |
NOAQOCXJZMJAMC-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM513864; PubChem:CID155788144
|
Local ready
Direct docking supported
|