| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L013161
BDB013161
|
US11207325, Example 159
COCCn1nc(C)c(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)c1C
|
C22H24FN7O2 437.479000 |
QQNPDWBNYQVGAI-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291844; PubChem:CID121433078
|
Local ready
Direct docking supported
|
|
E3L013162
BDB013162
|
US9580437, Example 160
Fc1ccc2c(c1CNc1ncc(-c3ccc(C(F)(F)F)nc3)c3nncn13)CCO2
|
C20H14F4N6O 430.365000 |
QWUVUBIJGXCRJG-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291845; PubChem:CID121432979
|
Local ready
Direct docking supported
|
|
E3L013163
BDB013163
|
US9580437, Example 161
COc1cc(F)c(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)cn1
|
C20H16F2N6O2 410.384000 |
FKIMGKSMUHFYPS-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291846; PubChem:CID121433082
|
Local ready
Direct docking supported
|
|
E3L013164
BDB013164
|
US9580437, Example 162
Fc1ccc2c(c1CNc1ncc(-c3ccncc3Cl)c3nncn13)CCO2
|
C19H14ClFN6O 396.813000 |
IOKDMBPWICKAAP-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291847; PubChem:CID121433004
|
Local ready
Direct docking supported
|
|
E3L013165
BDB013165
|
US9580437, Example 163
Cc1cnccc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cnnc12
|
C20H17FN6O 376.395000 |
KRWFLWWFUAILDB-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291848; PubChem:CID121433009
|
Local ready
Direct docking supported
|
|
E3L013166
BDB013166
|
US9580437, Example 164
Cc1nc(F)ccc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cnnc12
|
C20H16F2N6O 394.385000 |
LWXVRMZBZZZGRX-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291849; PubChem:CID121432858
|
Local ready
Direct docking supported
|
|
E3L013167
BDB013167
|
US9580437, Example 165
Cc1cc(F)ccc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cnnc12
|
C21H17F2N5O 393.397000 |
WOZANJUBZZPSFE-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291850; PubChem:CID121432863
|
Local ready
Direct docking supported
|
|
E3L013168
BDB013168
|
US9580437, Example 167
Cc1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)c(C)n1
|
C21H19FN6O 390.422000 |
GPOYFENWQYULOI-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291852; PubChem:CID121432883
|
Local ready
Direct docking supported
|
|
E3L013169
BDB013169
|
US9580437, Example 168
Fc1ccc2c(c1CNc1ncc(-c3cccnc3C(F)F)c3nncn13)CCO2
|
C20H15F3N6O 412.375000 |
YPYQBBHVZWUEJU-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291853; PubChem:CID121433080
|
Local ready
Direct docking supported
|
|
E3L013170
BDB013170
|
US9580437, Example 169
Cn1nccc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cnnc12
|
C18H16FN7O 365.372000 |
OCESHTFWRIZNHJ-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291854; PubChem:CID121433081
|
Local ready
Direct docking supported
|
|
E3L013171
BDB013171
|
US9580437, Example 170
Cn1cc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)c(F)n1
|
C18H15F2N7O 383.362000 |
HUPIEZUQZQHDAH-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291855; PubChem:CID137528701
|
Local ready
Direct docking supported
|
|
E3L013172
BDB013172
|
US9580437, Example 171
CC(=O)NCc1ccc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)cn1
|
C22H20FN7O2 433.447000 |
MPGWCMHQERYODZ-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291856; PubChem:CID121432866
|
Local ready
Direct docking supported
|
|
E3L013173
BDB013173
|
US9580437, Example 172
Cc1c(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)cnn1C
|
C19H18FN7O 379.399000 |
IDFJGFFNCRRYID-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291857; PubChem:CID121433012
|
Local ready
Direct docking supported
|
|
E3L013174
BDB013174
|
US9580437, Example 173
Cc1cc(C2CC2)ncc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cnnc12
|
C23H21FN6O 416.460000 |
XQAVUMLVCNDDEB-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291858; PubChem:CID121432887
|
Local ready
Direct docking supported
|
|
E3L013175
BDB013175
|
US9580437, Example 174
COc1ncc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)cn1
|
C19H16FN7O2 393.382000 |
HMTITUFTVCNPRK-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291859; PubChem:CID121433005
|
Local ready
Direct docking supported
|
|
E3L013176
BDB013176
|
US9580437, Example 175
COc1ncc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)c(C)n1
|
C20H18FN7O2 407.409000 |
UMZWZXQROIKLCJ-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291860; PubChem:CID121433079
|
Local ready
Direct docking supported
|
|
E3L013177
BDB013177
|
US9580437, Example 176
Cc1ncncc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cnnc12
|
C19H16FN7O 377.383000 |
ZOMVWEIFWIFJKG-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291861; PubChem:CID121433084
|
Local ready
Direct docking supported
|
|
E3L013178
BDB013178
|
US9580437, Example 177
Cc1nccc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)c1C
|
C21H19FN6O 390.422000 |
GQWNHQPLIIQMHA-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291862; PubChem:CID121433083
|
Local ready
Direct docking supported
|
|
E3L013179
BDB013179
|
US9580437, Example 178
Cc1cc(C#N)ccc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cnnc12
|
C22H17FN6O 400.417000 |
NNXSOVFXQIVDBQ-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2, Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM291863; PubChem:CID121433085
|
Local ready
Direct docking supported
|
|
E3L013180
BDB013180
|
US9580437, Example 179
Cc1nn(C2CC2)c(C)c1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cnnc12
|
C22H22FN7O 419.464000 |
AQMDZAWSEXSOPJ-UHFFFAOYSA-N | O75530 | Polycomb protein EED, Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM291864; PubChem:CID121432909
|
Local ready
Direct docking supported
|