| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L043101
BDB043101
|
BDBM50001130
CN[C@@H](C)C(=O)N[C@H]1CCC[C@H]2SC(C)(C)C(C(=O)Nc3cc(C)nn3-c3ccccc3)N2C1=O
|
C25H34N6O3S 498.653000 |
RBLGKKZTMVKMNE-CPCSJTIGSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM50001130
|
Local ready
Direct docking supported
|
|
E3L043102
BDB043102
|
BDBM50001131
CN[C@@H](C)C(=O)N[C@H]1CCC[C@H]2C[C@H]3CCN(CCc4ccccc4)C[C@H]3N2C1=O
|
C24H36N4O2 412.578000 |
LTFVDAMNPLQBHE-WFMNFSIZSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50001131; PubChem:CID90654404
|
Local ready
Direct docking supported
|
|
E3L043103
BDB043103
|
BDBM50001132
CN[C@@H](C)C(=O)N[C@H]1CCC[C@H]2C[C@H]3CCN(CCc4ccc(Br)cc4)C[C@H]3N2C1=O
|
C24H35BrN4O2 491.474000 |
BCFKWSBDCRMWRK-ORDMVQLLSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50001132; PubChem:CID90654405
|
Local ready
Direct docking supported
|
|
E3L043104
BDB043104
|
BDBM50001133
CN[C@@H](C)C(=O)N[C@H]1CCC[C@H]2C[C@H]3CCN(CCc4ccccc4F)C[C@H]3N2C1=O
|
C24H35FN4O2 430.568000 |
HPONQTAHVJCUCR-CRDRRFEFSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50001133; PubChem:CID90654406
|
Local ready
Direct docking supported
|
|
E3L043105
BDB043105
|
BDBM50001134
CN[C@@H](C)C(=O)N[C@H]1CCC[C@H]2C[C@H]3CCN(CCc4ccc(F)cc4)C[C@H]3N2C1=O
|
C24H35FN4O2 430.568000 |
NPUNAPHKJPGXNY-ORDMVQLLSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50001134; PubChem:CID90654407
|
Local ready
Direct docking supported
|
|
E3L043106
BDB043106
|
BDBM50001135
CN[C@@H](C)C(=O)N[C@H]1CCC[C@H]2C[C@H]3CCN(CCc4ccccc4OC)C[C@H]3N2C1=O
|
C25H38N4O3 442.604000 |
NDQMUJBKPCHPFP-WFMNFSIZSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50001135; PubChem:CID90654408
|
Local ready
Direct docking supported
|
|
E3L043107
BDB043107
|
BDBM50001136
CN[C@@H](C)C(=O)N[C@H]1CCC[C@H]2C[C@H]3CCN(CCc4cccc(OC)c4)C[C@H]3N2C1=O
|
C25H38N4O3 442.604000 |
PTCUWTLAVOGZOF-YFVPBJFGSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50001136; PubChem:CID90654409
|
Local ready
Direct docking supported
|
|
E3L043108
BDB043108
|
BDBM50001137
CN[C@@H](C)C(=O)N[C@H]1CCC[C@H]2C[C@H]3CCN(CCc4ccc(OC)cc4)C[C@H]3N2C1=O
|
C25H38N4O3 442.604000 |
HMOAPULCEFNNFJ-YFVPBJFGSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50001137; PubChem:CID90654410
|
Local ready
Direct docking supported
|
|
E3L043109
BDB043109
|
BDBM50001138
CN[C@@H](C)C(=O)N[C@H]1CCC[C@H]2C[C@H]3CCN(CCc4ccc(O)cc4)C[C@H]3N2C1=O
|
C24H36N4O3 428.577000 |
HNEFKNCSOQRMCU-CRDRRFEFSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50001138; PubChem:CID90654411
|
Local ready
Direct docking supported
|
|
E3L043110
BDB043110
|
BDBM50001139
CN[C@@H](C)C(=O)N[C@H]1CCC[C@H]2C[C@H]3CCN(CCc4ccccc4C)C[C@H]3N2C1=O
|
C25H38N4O2 426.605000 |
VUHJRMSITOPODU-JELQSWKKSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50001139; PubChem:CID90654412
|
Local ready
Direct docking supported
|
|
E3L043111
BDB043111
|
BDBM50001140
CN[C@@H](C)C(=O)N[C@H]1CCC[C@@H]2C[C@H]3CCN(CCc4ccccc4)C[C@H]3N2C1=O
|
C24H36N4O2 412.578000 |
LTFVDAMNPLQBHE-KMHBYZIFSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50001140; PubChem:CID90654413
|
Local ready
Direct docking supported
|
|
E3L043112
BDB043112
|
BDBM50001919
COc1ccccc1N1CCN(C(=O)[C@]2(Oc3ccc(C(F)(F)F)cc3)CCCN(C(=O)c3cnccc3C(F)(F)F)C2)CC1
|
C31H30F6N4O4 636.593000 |
PZSVOCNSQBDEGM-LJAQVGFWSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50001919; PubChem:CID90654509
|
Local ready
Direct docking supported
|
|
E3L043113
BDB043113
|
BDBM50001920
COCCOc1ccccc1N1CCN(C(=O)[C@]2(Oc3ccc(C(F)(F)F)cc3)CCCN(C(=O)c3cnccc3C(F)(F)F)C2)CC1
|
C33H34F6N4O5 680.646000 |
CRIWMVCCGZFDSF-HKBQPEDESA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50001920; PubChem:CID90654510
|
Local ready
Direct docking supported
|
|
E3L043114
BDB043114
|
BDBM50001921
COCCOc1ccccc1N1CCN(C(=O)[C@]2(Oc3ccc(C(F)(F)F)cc3)C[C@@H](C)CN(C(=O)c3cnccc3C(F)(F)F)C2)CC1
|
C34H36F6N4O5 694.673000 |
TYDCBADLAJZMLC-HEIROHQZSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50001921
|
Local ready
Direct docking supported
|
|
E3L043115
BDB043115
|
BDBM50001923
COCCOc1ccccc1N1CCN(C(=O)[C@]2(Oc3ccc(C(F)(F)F)cc3)C[C@H](C)CN(C(=O)c3cnccc3C(F)(F)F)C2)CC1
|
C34H36F6N4O5 694.673000 |
TYDCBADLAJZMLC-UDNBHOFDSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50001923
|
Local ready
Direct docking supported
|
|
E3L043116
BDB043116
|
BDBM50001924
COCCOc1ccccc1N1CCN(C(=O)[C@@]2(Oc3ccc(C(F)(F)F)cc3)CN(C(=O)c3cnccc3C(F)(F)F)CC(C)(C)C2)CC1
|
C35H38F6N4O5 708.700000 |
RWWVDUXUHIXFLY-XIFFEERXSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50001924
|
Local ready
Direct docking supported
|
|
E3L043117
BDB043117
|
BDBM50001925
COc1ccccc1N1CCN(C(=O)[C@]2(Oc3ccc(C(F)(F)F)cc3)C[C@H](c3ccccc3)CN(C(=O)c3cnccc3C(F)(F)F)C2)CC1
|
C37H34F6N4O4 712.691000 |
LSPICVFNSJPUEE-CYFIQEHSSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50001925; PubChem:CID90654512
|
Local ready
Direct docking supported
|
|
E3L043118
BDB043118
|
BDBM50001926
COCCOc1ccccc1N1CCN(C(=O)[C@@]2(Oc3ccc(C(F)(F)F)cc3)CN(C(=O)c3cnccc3C(F)(F)F)CC[C@H]2c2ccc(F)cc2)CC1
|
C39H37F7N4O5 774.734000 |
QEYGBTXOAOKISI-DWEWYUIOSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50001926
|
Local ready
Direct docking supported
|
|
E3L043119
BDB043119
|
BDBM50001927
COCCOc1ccccc1N1CCN(C(=O)[C@]2(Oc3ccc(C(F)(F)F)cc3)CC[C@H](c3ccccc3)N(C(=O)c3cnccc3C(F)(F)F)C2)CC1
|
C39H38F6N4O5 756.744000 |
WWYQXLBDFNZIFA-JJQXXVEZSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50001927
|
Local ready
Direct docking supported
|
|
E3L043120
BDB043120
|
BDBM50001928
COc1ccccc1N1CCN(C(=O)[C@]2(Oc3ccc(C(F)(F)F)cc3)C[C@@H]3C[C@@H]3N(C(=O)c3cnccc3C(F)(F)F)C2)CC1
|
C32H30F6N4O4 648.604000 |
GOMYHFSPYIOHQU-OHKIHNLFSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50001928
|
Local ready
Direct docking supported
|