| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L033121
BDB033121
|
US11919855, Name NUCC-0226236
CC1(C)C(=O)N(Cc2cccc(C(F)(F)F)c2)CC1NC(=O)c1cc(C(F)(F)F)ccc1O
|
C22H20F6N2O3 474.401000 |
UQVGIFBMUZLOMG-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM656465; PubChem:CID167217838
|
Local ready
Direct docking supported
|
|
E3L033122
BDB033122
|
US11919855, Name NUCC-0226237
COC(=O)c1ccccc1CN1CC(NC(=O)c2cc(C(F)(F)F)ccc2O)CCC1=O
|
C22H21F3N2O5 450.413000 |
HWABPMLNPZLMRS-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM656466; PubChem:CID167218435
|
Local ready
Direct docking supported
|
|
E3L033123
BDB033123
|
US11919855, Name NUCC-0226238
O=C(N[C@H]1CCN(Cc2cccc(C(F)(F)F)c2)C1=O)c1cc(C(F)(F)F)ccc1O
|
C20H16F6N2O3 446.347000 |
ITNHHNGZNYWNJA-HNNXBMFYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM656467; PubChem:CID167217860
|
Local ready
Direct docking supported
|
|
E3L033124
BDB033124
|
US11919855, Name NUCC-0226240
O=C(NCC1CCC(=O)N1Cc1cccc(C(F)(F)F)c1)c1cc(C(F)(F)F)ccc1O
|
C21H18F6N2O3 460.374000 |
APRKFCUCNYGLMO-UHFFFAOYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM656468; PubChem:CID167218118
|
Local ready
Direct docking supported
|
|
E3L033125
BDB033125
|
US11919855, Name NUCC-0226241
O=C(NC[C@@H]1CCC(=O)N1Cc1cccc(C(F)(F)F)c1)c1cc(C(F)(F)F)ccc1O
|
C21H18F6N2O3 460.374000 |
APRKFCUCNYGLMO-HNNXBMFYSA-N | O75530 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM656469; PubChem:CID167218114
|
Local ready
Direct docking supported
|
|
E3L033126
BDB033126
|
US11919855, Name NUCC-0226242
O=C(NC[C@H]1CCC(=O)N1Cc1cccc(C(F)(F)F)c1)c1cc(C(F)(F)F)ccc1O
|
C21H18F6N2O3 460.374000 |
APRKFCUCNYGLMO-OAHLLOKOSA-N | O75530 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM656470; PubChem:CID167218225
|
Local ready
Direct docking supported
|
|
E3L033127
BDB033127
|
US11919855, Name NUCC-0226243
O=C(NC[C@H]1CC(=O)N(Cc2cccc(F)c2)C1)c1cc(C(F)(F)F)ccc1O
|
C20H18F4N2O3 410.367000 |
GWUGUQRDAWZRBZ-CYBMUJFWSA-N | O75530 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM656471; PubChem:CID166031167
|
Local ready
Direct docking supported
|
|
E3L033128
BDB033128
|
US11919855, Name NUCC-0226244
O=C(NC[C@@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1)c1cc(C(F)(F)F)ccc1O
|
C21H18F6N2O3 460.374000 |
XGTGSXQWUZYADE-ZDUSSCGKSA-N | O75530 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM656472; PubChem:CID167218121
|
Local ready
Direct docking supported
|
|
E3L033129
BDB033129
|
US11919855, Name NUCC-0226245
O=C(N[C@@H]1CCN(Cc2cccc(C(F)(F)F)c2)C1=O)c1cc(C(F)(F)F)ccc1O
|
C20H16F6N2O3 446.347000 |
ITNHHNGZNYWNJA-OAHLLOKOSA-N | O75530 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM656473; PubChem:CID167217923
|
Local ready
Direct docking supported
|
|
E3L033130
BDB033130
|
BDBM656589
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(C)(=O)=O)CO3)CC2)C1)C(C)C
|
C30H43FN6O5S 618.776000 |
XCJFBDRDSXJTNG-RPWUZVMVSA-N | Q03164 | Menin |
BindingDB, PubChem
BindingDB:BDBM656589; PubChem:CID166131394
|
Local ready
Direct docking supported
|
|
E3L033131
BDB033131
|
BDBM656590
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)CC)CO3)CC2)C1)C(C)C
|
C31H45FN6O5S 632.803000 |
MYHKPCHFHONPJC-RPBOFIJWSA-N | Q03164 | Menin |
BindingDB, PubChem
BindingDB:BDBM656590; PubChem:CID166131282
|
Local ready
Direct docking supported
|
|
E3L033132
BDB033132
|
BDBM656591
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)C(C)C)CO3)CC2)C1)C(C)C
|
C32H47FN6O5S 646.830000 |
KKAZESFVLSLRKX-FTJBHMTQSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656591
|
Local ready
Direct docking supported
|
|
E3L033133
BDB033133
|
BDBM656592
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)C4CC4)CO3)CC2)C1)C(C)C
|
C32H45FN6O5S 644.814000 |
GIHFQOHDPOUVPC-RPBOFIJWSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656592
|
Local ready
Direct docking supported
|
|
E3L033134
BDB033134
|
BDBM656593
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)C4COC4)CO3)CC2)C1)C(C)C
|
C32H45FN6O6S 660.813000 |
FTCAGFFHMPXBNQ-RPBOFIJWSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656593
|
Local ready
Direct docking supported
|
|
E3L033135
BDB033135
|
BDBM656594
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)C4CCC4)CO3)CC2)C1)C(C)C
|
C33H47FN6O5S 658.841000 |
WONRQYLFABXYAX-FTJBHMTQSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656594
|
Local ready
Direct docking supported
|
|
E3L033136
BDB033136
|
BDBM656595
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)CC4CC4)CO3)CC2)C1)C(C)C
|
C33H47FN6O5S 658.841000 |
NYBPNYJPMVRJEN-SXOMAYOGSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656595
|
Local ready
Direct docking supported
|
|
E3L033137
BDB033137
|
BDBM656596
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)CCOC)CO3)CC2)C1)C(C)C
|
C32H47FN6O6S 662.829000 |
DWHRHCCYMCYOPZ-FTJBHMTQSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656596
|
Local ready
Direct docking supported
|
|
E3L033138
BDB033138
|
BDBM656597
CCCS(=O)(=O)N[C@@H]1CC[C@@H](CN2CCC3(CC2)CN(c2ncncc2Oc2ccc(F)cc2C(=O)N(CC)C(C)C)C3)OC1
|
C32H47FN6O5S 646.830000 |
MRGICMISJREONY-FTJBHMTQSA-N | Q03164 | Menin |
BindingDB, PubChem
BindingDB:BDBM656597; PubChem:CID166131460
|
Local ready
Direct docking supported
|
|
E3L033139
BDB033139
|
BDBM656598
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)C4CCOC4)CO3)CC2)C1)C(C)C
|
C33H47FN6O6S 674.840000 |
JCTBGOYFOQWDJV-JZGSEIKYSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656598
|
Local ready
Direct docking supported
|
|
E3L033140
BDB033140
|
BDBM656599
CCN(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)CO3)CC2)C1)C(C)C
|
C34H49FN6O5 640.801000 |
JONNCJLHHNQNOY-FTJBHMTQSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656599
|
Local ready
Direct docking supported
|