| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L033141
BDB033141
|
BDBM656601
CC(C)N(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(C)(=O)=O)CO3)CC2)C1)C(C)C
|
C31H45FN6O5S 632.803000 |
HJLLYWWQJDHYIY-RPBOFIJWSA-N | Q03164 | Menin |
BindingDB, PubChem
BindingDB:BDBM656601; PubChem:CID166131424
|
Local ready
Direct docking supported
|
|
E3L033142
BDB033142
|
BDBM656602
CCS(=O)(=O)N[C@@H]1CC[C@@H](CN2CCC3(CC2)CN(c2ncncc2Oc2ccc(F)cc2C(=O)N(C(C)C)C(C)C)C3)OC1
|
C32H47FN6O5S 646.830000 |
PKJNZXTYPPOOHY-FTJBHMTQSA-N | Q03164 | Menin |
BindingDB, PubChem
BindingDB:BDBM656602; PubChem:CID166131366
|
Local ready
Direct docking supported
|
|
E3L033143
BDB033143
|
BDBM656610
CC(C)N(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)C(C)C)CO3)CC2)C1)C(C)C
|
C33H49FN6O5S 660.857000 |
RJIMETIFOXQUCE-SXOMAYOGSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656610
|
Local ready
Direct docking supported
|
|
E3L033144
BDB033144
|
BDBM656611
CC(C)N(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)C4CC4)CO3)CC2)C1)C(C)C
|
C33H47FN6O5S 658.841000 |
ZJXGOGDBRCAQHT-FTJBHMTQSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656611
|
Local ready
Direct docking supported
|
|
E3L033145
BDB033145
|
BDBM656612
CC(C)N(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)C4COC4)CO3)CC2)C1)C(C)C
|
C33H47FN6O6S 674.840000 |
VBIBTRVXDVTVGP-FTJBHMTQSA-N | Q03164 | Menin |
BindingDB, PubChem
BindingDB:BDBM656612; PubChem:CID166131398
|
Local ready
Direct docking supported
|
|
E3L033146
BDB033146
|
BDBM656613
CC(C)N(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)CO3)CC2)C1)C1CC1
|
C35H49FN6O5 652.812000 |
AUOUIICKWATATC-VPUSJEBWSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656613
|
Local ready
Direct docking supported
|
|
E3L033147
BDB033147
|
BDBM656623
CC(C)N(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(C)(=O)=O)CO3)CC2)C1)C1CC1
|
C31H43FN6O5S 630.787000 |
OGBDVNXNMBLSPG-NOZRDPDXSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656623
|
Local ready
Direct docking supported
|
|
E3L033148
BDB033148
|
BDBM656624
CCS(=O)(=O)N[C@@H]1CC[C@@H](CN2CCC3(CC2)CN(c2ncncc2Oc2ccc(F)cc2C(=O)N(C(C)C)C2CC2)C3)OC1
|
C32H45FN6O5S 644.814000 |
QKIOANKAOALRMD-RSXGOPAZSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656624
|
Local ready
Direct docking supported
|
|
E3L033149
BDB033149
|
BDBM656625
CC(C)N(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)C(C)C)CO3)CC2)C1)C1CC1
|
C33H47FN6O5S 658.841000 |
VQQWJJMZGNSSBY-VPUSJEBWSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656625
|
Local ready
Direct docking supported
|
|
E3L033150
BDB033150
|
BDBM656626
CC(C)N(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)C4CC4)CO3)CC2)C1)C1CC1
|
C33H45FN6O5S 656.825000 |
YXPFMVDZGSJUCQ-RSXGOPAZSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656626
|
Local ready
Direct docking supported
|
|
E3L033151
BDB033151
|
BDBM656627
CC(C)N(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)C4COC4)CO3)CC2)C1)C1CC1
|
C33H45FN6O6S 672.824000 |
WUORNOFPZRWKDY-RSXGOPAZSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656627
|
Local ready
Direct docking supported
|
|
E3L033152
BDB033152
|
BDBM656628
C[C@@H]1COC[C@H](C)N1C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(C)(=O)=O)CO3)CC2)C1
|
C31H43FN6O6S 646.786000 |
TUUCBILULVSBPP-OUMDNPPYSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656628
|
Local ready
Direct docking supported
|
|
E3L033153
BDB033153
|
BDBM656629
CCS(=O)(=O)N[C@@H]1CC[C@@H](CN2CCC3(CC2)CN(c2ncncc2Oc2ccc(F)cc2C(=O)N2[C@H](C)COC[C@@H]2C)C3)OC1
|
C32H45FN6O6S 660.813000 |
AKUUUBIIQOEVTK-RYJQUDHMSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656629
|
Local ready
Direct docking supported
|
|
E3L033154
BDB033154
|
BDBM656630
CC(C)S(=O)(=O)N[C@@H]1CC[C@@H](CN2CCC3(CC2)CN(c2ncncc2Oc2ccc(F)cc2C(=O)N2[C@H](C)COC[C@@H]2C)C3)OC1
|
C33H47FN6O6S 674.840000 |
QDCJPEZKVZKGBS-PTJMHOJZSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656630
|
Local ready
Direct docking supported
|
|
E3L033155
BDB033155
|
BDBM656631
C[C@@H]1COC[C@H](C)N1C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)C4CC4)CO3)CC2)C1
|
C33H45FN6O6S 672.824000 |
BRHCPLIOAAARSE-RYJQUDHMSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656631
|
Local ready
Direct docking supported
|
|
E3L033156
BDB033156
|
BDBM656633
C[C@@H]1COC[C@@H](C)N1C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(C)(=O)=O)CO3)CC2)C1
|
C31H43FN6O6S 646.786000 |
TUUCBILULVSBPP-MFYODDQASA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656633
|
Local ready
Direct docking supported
|
|
E3L033157
BDB033157
|
BDBM656634
CCS(=O)(=O)N[C@@H]1CC[C@@H](CN2CCC3(CC2)CN(c2ncncc2Oc2ccc(F)cc2C(=O)N2[C@H](C)COC[C@H]2C)C3)OC1
|
C32H45FN6O6S 660.813000 |
AKUUUBIIQOEVTK-YUEVXQQWSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656634
|
Local ready
Direct docking supported
|
|
E3L033158
BDB033158
|
BDBM656635
CC(C)S(=O)(=O)N[C@@H]1CC[C@@H](CN2CCC3(CC2)CN(c2ncncc2Oc2ccc(F)cc2C(=O)N2[C@H](C)COC[C@H]2C)C3)OC1
|
C33H47FN6O6S 674.840000 |
QDCJPEZKVZKGBS-RSQMYVMBSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656635
|
Local ready
Direct docking supported
|
|
E3L033159
BDB033159
|
BDBM656636
C[C@@H]1COC[C@@H](C)N1C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)C4CC4)CO3)CC2)C1
|
C33H45FN6O6S 672.824000 |
BRHCPLIOAAARSE-YUEVXQQWSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656636
|
Local ready
Direct docking supported
|
|
E3L033160
BDB033160
|
BDBM656637
C[C@@H]1COC[C@@H](C)N1C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(C[C@@H]3CC[C@@H](NS(=O)(=O)C4COC4)CO3)CC2)C1
|
C33H45FN6O7S 688.823000 |
RYTGRRNMLSXVBU-YUEVXQQWSA-N | Q03164 | Menin |
BindingDB
BindingDB:BDBM656637
|
Local ready
Direct docking supported
|