| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L057281
BDB057281
|
BDBM50465627
CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCCC1c1nc2ccccc2[nH]1)C(C)C
|
C20H29N5O2 371.485000 |
IWDSIIJPDGBPOK-KAKCIXEOSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50465627; PubChem:CID145986086
|
Local ready
Direct docking supported
|
|
E3L057282
BDB057282
|
BDBM50465628
CN[C@@H](C)C(=O)N[C@@H](Cc1ccc(S(=O)(=O)O)cc1)C(=O)N1CCC[C@@H]1c1cncc(Cc2ccccc2)n1
|
C28H33N5O5S 551.669000 |
BSKILDRWLGURMA-VFHOHQAYSA-N | P98170, Q13489, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM50465628; PubChem:CID142585287
|
Local ready
Direct docking supported
|
|
E3L057283
BDB057283
|
BDBM50465629
CN[C@@H](C)C(=O)N[C@@H](Cc1ccc(C(F)(F)F)c(Cl)c1)C(=O)N1CCC[C@@H]1c1cncc(Cc2ccccc2)n1
|
C29H31ClF3N5O2 574.047000 |
SZOGURXUQQJNKI-ZNCVFPSASA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM50465629
|
Local ready
Direct docking supported
|
|
E3L057284
BDB057284
|
BDBM50465630
CN[C@@H](C)C(=O)N[C@@H](CCN)C(=O)N1CCC[C@@H]1C(=O)N[C@@H]1CCc2c(F)cccc21
|
C22H32FN5O3 433.528000 |
NWJPNEPAUOWBDK-NUDXDXSLSA-N | P98170, Q13489, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM50465630; PubChem:CID145985393
|
Local ready
Direct docking supported
|
|
E3L057285
BDB057285
|
BDBM50465631
CN[C@@H](C)C(=O)N[C@@H](CNC(=O)c1ccc(S(=O)(=O)F)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O
|
C28H35FN6O7S 618.688000 |
HFSDFPGWRRLCFG-ZMVGRULKSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB
BindingDB:BDBM50465631
|
Local ready
Direct docking supported
|
|
E3L057286
BDB057286
|
BDBM50465632
CN[C@@H](C)C(=O)N[C@@H](CNC(=O)c1ccc(S(=O)(=O)F)cc1)C(=O)N1CCC[C@H]1c1cncc(Cc2cccc(F)c2)n1
|
C29H32F2N6O5S 614.675000 |
OJNVAHCYXGMTQI-ATANMQQVSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM50465632
|
Local ready
Direct docking supported
|
|
E3L057287
BDB057287
|
Me-Ala-Val-Pro-Phe-NH2
CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C(C)C
|
C23H35N5O4 445.564000 |
RZTONEAWEFUHTL-WNHJNPCNSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50465633; PubChem:CID58609608
|
Local ready
Direct docking supported
|
|
E3L057288
BDB057288
|
Me-Ala-Phe(4-CH2PO3H2)-Pro-Phe-NH2
CN[C@@H](C)C(=O)N[C@@H](Cc1ccc(CP(=O)(O)O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O
|
C28H38N5O7P 587.614000 |
AGUANHCNVQFXGF-IMNFJDCFSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM50465634; PubChem:CID145986444
|
Local ready
Direct docking supported
|
|
E3L057289
BDB057289
|
Me-Ala-Phe(4-MeSO3H)-Pro-Phe-NH2
CN[C@@H](C)C(=O)N[C@@H](Cc1ccc(CS(=O)(=O)O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O
|
C28H37N5O7S 587.699000 |
CERPHNRCHWANSS-IMNFJDCFSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50465635; PubChem:CID145991547
|
Local ready
Direct docking supported
|
|
E3L057290
BDB057290
|
BDBM50465636
CN[C@@H](C)C(=O)N[C@@H](Cc1ccc(C(F)(F)F)c(Cl)c1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O
|
C28H33ClF3N5O4 596.050000 |
ZJLYTXFENSNXNE-KKPKCPPISA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM50465636
|
Local ready
Direct docking supported
|
|
E3L057291
BDB057291
|
Me-Ala-Chg-Pro-Phe-NH2
CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C1CCCCC1
|
C26H39N5O4 485.629000 |
KCYWAEGWMORCLM-MQGJPIDWSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50465637; PubChem:CID145979422
|
Local ready
Direct docking supported
|
|
E3L057292
BDB057292
|
BDBM50465638
CN[C@@H](C)C(=O)N[C@@H](Cc1ccc(C(F)(F)F)cc1F)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O
|
C28H33F4N5O4 579.595000 |
DLLMKTZMYZBJCF-KKPKCPPISA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM50465638
|
Local ready
Direct docking supported
|
|
E3L057293
BDB057293
|
Me-Ala-Phe(4-CF3)-Pro-Phe-NH2
CN[C@@H](C)C(=O)N[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O
|
C28H34F3N5O4 561.605000 |
IXCFIOBPQJQGFM-ZMVGRULKSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50465639; PubChem:CID145986939
|
Local ready
Direct docking supported
|
|
E3L057294
BDB057294
|
BDBM50465640
[C][N][C@@H]([C])C(=O)[N][C@@H]([C]c1ccc(N=C([N])[N])cc1)C(=O)N1[C][C][C][C@H]1C(=O)[N][C@@H]([C]c1ccccc1)C([N])=O
|
C28H13N8O4 525.464000 |
KLTWEUTYDDDQDZ-ZMVGRULKSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM50465640
|
Local ready
Direct docking supported
|
|
E3L057295
BDB057295
|
BDBM50465641
CN[C@@H](C)C(=O)N[C@@H](Cc1cc(C)c(C(F)(F)F)cc1F)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O
|
C29H35F4N5O4 593.622000 |
JWOTZLOUVNBSBR-NSXWQBIQSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM50465641
|
Local ready
Direct docking supported
|
|
E3L057296
BDB057296
|
BDBM50465642
CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1c1nc(-c2ccccn2)no1)C(C)C
|
C20H28N6O3 400.483000 |
ACHPYIQTTPANDJ-BPUTZDHNSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50465642; PubChem:CID145987993
|
Local ready
Direct docking supported
|
|
E3L057297
BDB057297
|
BDBM50465643
CN[C@@H](C)C(=O)N[C@@H](Cc1ccc(N=C(N)N)cc1)C(=O)N1CCCC1c1nc2ccccc2[nH]1
|
C25H32N8O2 476.585000 |
FGLYVGSXVVJJFG-XABNSEFBSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM50465643; PubChem:CID142585365
|
Local ready
Direct docking supported
|
|
E3L057298
BDB057298
|
BDBM50465644
CN[C@@H](C)C(=O)N[C@@H](Cc1ccc(CP(=O)(O)O)cc1)C(=O)N1CCC[C@@H]1C(=O)NC1Cc2ccccc2C1
|
C28H37N4O6P 556.600000 |
JIDWKTJXOGCVKX-RIEVBORMSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50465644; PubChem:CID145981512
|
Local ready
Direct docking supported
|
|
E3L057299
BDB057299
|
BDBM50465645
CN[C@@H](C)C(=O)N[C@@H](Cc1cc(C)c(C(F)(F)F)cc1F)C(=O)N1CCC[C@H]1C(=O)N[C@@H]1CCc2c(F)cccc21
|
C29H33F5N4O3 580.598000 |
NTTJUNKJFQKLSG-RGWZMNCVSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM50465645
|
Local ready
Direct docking supported
|
|
E3L057300
BDB057300
|
BDBM50465646
CN[C@@H](C)C(=O)N[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H]1CCc2c(F)cccc21
|
C27H32FN5O5 525.581000 |
HZUXFPDGVMNOOO-ZFIFVKQDSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50465646; PubChem:CID145979112
|
Local ready
Direct docking supported
|