| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L013221
BDB013221
|
US9580437, Example 220
CN1CCC(S(=O)(=O)c2ccc(-c3cnc(NCc4cccc5occc45)n4cnnc34)cc2)CC1
|
C26H26N6O3S 502.600000 |
VZTRXNJTMMFEKF-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291905; PubChem:CID121432898
|
Local ready
Direct docking supported
|
|
E3L013222
BDB013222
|
US9580437, Example 222
Cc1cc(C)c(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)cn1
|
C21H19FN6O 390.422000 |
IZGKHRJIAQLSSB-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291907; PubChem:CID121432901
|
Local ready
Direct docking supported
|
|
E3L013223
BDB013223
|
US9580437, Example 223
Cc1nc(CN(C)C)ccc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cnnc12
|
C23H24FN7O 433.491000 |
BHBLCFLAEZNRFT-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291908; PubChem:CID121431699
|
Local ready
Direct docking supported
|
|
E3L013224
BDB013224
|
US9580437, Example 224
CCc1cc(C)c(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)cn1
|
C22H21FN6O 404.449000 |
HFFMKDPDYXSYTK-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291909; PubChem:CID121433023
|
Local ready
Direct docking supported
|
|
E3L013225
BDB013225
|
US9580437, Example 225
Cc1nc(OC2CC2)ncc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cnnc12
|
C22H20FN7O2 433.447000 |
RDOJDGMXTYOULW-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291910; PubChem:CID121433024
|
Local ready
Direct docking supported
|
|
E3L013226
BDB013226
|
US9580437, Example 226
CCOc1ncc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)c(C)n1
|
C21H20FN7O2 421.436000 |
LXAVJONJUUHXQC-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291911; PubChem:CID121433109
|
Local ready
Direct docking supported
|
|
E3L013227
BDB013227
|
US9580437, Example 227
Cn1ncc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)c1CO
|
C19H18FN7O2 395.398000 |
OXICPRAQBJWTNI-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291912; PubChem:CID121433025
|
Local ready
Direct docking supported
|
|
E3L013228
BDB013228
|
US9580437, Example 228
Cc1cnc(Cl)cc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cnnc12
|
C20H16ClFN6O 410.840000 |
BAPZVZCCTXRUOZ-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291913; PubChem:CID121433026
|
Local ready
Direct docking supported
|
|
E3L013229
BDB013229
|
US9580437, Example 229
CCc1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)c(C)n1
|
C22H21FN6O 404.449000 |
QXOWLBKQZJYDBS-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291914; PubChem:CID121432902
|
Local ready
Direct docking supported
|
|
E3L013230
BDB013230
|
US9580437, Example 230
COc1nccc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)c1C
|
C21H19FN6O2 406.421000 |
GSOOGSOSZUQKIR-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291915; PubChem:CID121432903
|
Local ready
Direct docking supported
|
|
E3L013231
BDB013231
|
US9580437, Example 231
Fc1ccc2c(c1CNc1ncc(-c3ccccn3)c3nncn13)CCO2
|
C19H15FN6O 362.368000 |
BKNAMNWNBQTSBN-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291916; PubChem:CID121432906
|
Local ready
Direct docking supported
|
|
E3L013232
BDB013232
|
US9580437, Example 232
Cc1cncc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)c1
|
C20H17FN6O 376.395000 |
IOKAODORPXSHDF-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291917; PubChem:CID121432918
|
Local ready
Direct docking supported
|
|
E3L013233
BDB013233
|
US9580437, Example 233
Cc1cn(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)cn1
|
C18H16FN7O 365.372000 |
DNXQPHQAMCRLAS-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291918; PubChem:CID121412524
|
Local ready
Direct docking supported
|
|
E3L013234
BDB013234
|
US9580437, Example 234
OCc1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)cn1
|
C20H17FN6O2 392.394000 |
RKAQCAZCQNMZBG-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291919; PubChem:CID121432920
|
Local ready
Direct docking supported
|
|
E3L013235
BDB013235
|
US9580437, Example 235
Fc1ccc2c(c1CNc1ncc(F)c3nncn13)CCO2
|
C14H11F2N5O 303.272000 |
LSNNVXZFVYOPHU-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291920; PubChem:CID121433107
|
Local ready
Direct docking supported
|
|
E3L013236
BDB013236
|
US9580437, Example 236
Cc1cn(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)c(C)n1
|
C19H18FN7O 379.399000 |
DLOCERYQNWPSFY-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291921; PubChem:CID121432921
|
Local ready
Direct docking supported
|
|
E3L013237
BDB013237
|
US9580437, Example 237
Fc1ccc2c(c1CNc1ncc(-n3cccn3)c3nncn13)CCO2
|
C17H14FN7O 351.345000 |
QTMIDSFRFMBIMS-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291922; PubChem:CID121432922
|
Local ready
Direct docking supported
|
|
E3L013238
BDB013238
|
US9580437, Example 238
Cc1ncn(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)n1
|
C17H15FN8O 366.360000 |
OSZBNUACSVDTOS-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291923; PubChem:CID121433027
|
Local ready
Direct docking supported
|
|
E3L013239
BDB013239
|
US9580437, Example 239
Cc1cnn(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)c1
|
C18H16FN7O 365.372000 |
FTIMFONTIARMSZ-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291924; PubChem:CID121432907
|
Local ready
Direct docking supported
|
|
E3L013240
BDB013240
|
US9580437, Example 240
Fc1ccc2c(c1CNc1ncc(-n3ccnc3)c3nncn13)CCO2
|
C17H14FN7O 351.345000 |
ATHKBEKKKUVVAJ-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291925; PubChem:CID121432923
|
Local ready
Direct docking supported
|