| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L001581
BDB001581
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 40a
CCNC[C@H]1CC[C@H]2CC[C@@H](C(=O)NC(c3ccccc3)c3ccccc3)N2C(=O)[C@H]1NC(=O)[C@@H](N)CC
|
C30H41N5O3 519.690000 |
DXHHOMHJRYFCHK-HOIWYFOJSA-N | P98170, Q13489 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM32588; PubChem:CID44237049
|
Local ready
Direct docking supported
|
|
E3L001582
BDB001582
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 40c
CC[C@H](N)C(=O)N[C@@H]1C(=O)N2[C@@H](CC[C@@H]1CNCc1ccccc1)CC[C@H]2C(=O)NC(c1ccccc1)c1ccccc1
|
C35H43N5O3 581.761000 |
AMPOPSQVVNLFPN-HVSNEVFASA-N | P98170, Q13489 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM32589; PubChem:CID44237050
|
Local ready
Direct docking supported
|
|
E3L001583
BDB001583
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 20a
CC[C@H](N)C(=O)N[C@@H]1C(=O)N2[C@@H](CC[C@@H]1CN(C)Cc1ccccc1)CC[C@H]2C(=O)NC(c1ccccc1)c1ccccc1
|
C36H45N5O3 595.788000 |
BWLSZCKRHLWKLH-PIXGQMGXSA-N | P98170, Q13489 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM32590; PubChem:CID44237051
|
Local ready
Direct docking supported
|
|
E3L001584
BDB001584
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 20b
CC[C@H](N)C(=O)N[C@@H]1C(=O)N2[C@@H](CC[C@@H]1CN(CC)Cc1ccccc1)CC[C@H]2C(=O)NC(c1ccccc1)c1ccccc1
|
C37H47N5O3 609.815000 |
ZHNPIYLLDWNMTK-UCDLYESDSA-N | P98170, Q13489 | Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM32591; PubChem:CID44237052
|
Local ready
Direct docking supported
|
|
E3L001585
BDB001585
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 20c
CC[C@H](N)C(=O)N[C@@H]1C(=O)N2[C@@H](CC[C@@H]1CN(CC)CC)CC[C@H]2C(=O)NC(c1ccccc1)c1ccccc1
|
C32H45N5O3 547.744000 |
UIAACWOVDAQNKS-IYYUCAQOSA-N | P98170, Q13489 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM32592; PubChem:CID44237053
|
Local ready
Direct docking supported
|
|
E3L001586
BDB001586
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 22a
CC[C@H](N)C(=O)N[C@@H]1C(=O)N2[C@@H](CC[C@@H]1CNC(=O)CN)CC[C@H]2C(=O)NC(c1ccccc1)c1ccccc1
|
C30H40N6O4 548.688000 |
NITVCSOMZUDMAD-GKPVTSGTSA-N | P98170, Q13489 | Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM32593; PubChem:CID44237054
|
Local ready
Direct docking supported
|
|
E3L001587
BDB001587
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 22b
CC[C@H](N)C(=O)N[C@@H]1C(=O)N2[C@@H](CC[C@@H]1CNC(C)=O)CC[C@H]2C(=O)NC(c1ccccc1)c1ccccc1
|
C30H39N5O4 533.673000 |
FGVJZVMUQHWRBE-HOIWYFOJSA-N | P98170, Q13489 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM32594; PubChem:CID44237055
|
Local ready
Direct docking supported
|
|
E3L001588
BDB001588
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 36a
CC[C@H](N)C(=O)N[C@@H]1C(=O)N2[C@@H](CC[C@@H]1CNC(=O)c1ccccc1)CC[C@H]2C(=O)NC(c1ccccc1)c1ccccc1
|
C35H41N5O4 595.744000 |
BKCCBNUDADJBCR-QSXRPSNWSA-N | P98170, Q13489 | Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM32595; PubChem:CID44237056
|
Local ready
Direct docking supported
|
|
E3L001589
BDB001589
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 24a
CC[C@H](N)C(=O)N[C@@H]1C(=O)N2[C@@H](CC[C@@H]1CNS(C)(=O)=O)CC[C@H]2C(=O)NC(c1ccccc1)c1ccccc1
|
C29H39N5O5S 569.728000 |
NBFJVEWYOWDDRD-VEGWMBEDSA-N | P98170, Q13489 | Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM32596; PubChem:CID44237057
|
Local ready
Direct docking supported
|
|
E3L001590
BDB001590
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 24b
CC[C@H](N)C(=O)N[C@@H]1C(=O)N2[C@@H](CC[C@@H]1CNS(=O)(=O)c1ccc(C)cc1)CC[C@H]2C(=O)NC(c1ccccc1)c1ccccc1
|
C35H43N5O5S 645.826000 |
VMODNEWYLILSMS-YSOADSQMSA-N | P98170, Q13489 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM32597; PubChem:CID44237058
|
Local ready
Direct docking supported
|
|
E3L001591
BDB001591
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 26a
CCNC(=O)NC[C@H]1CC[C@H]2CC[C@@H](C(=O)NC(c3ccccc3)c3ccccc3)N2C(=O)[C@H]1NC(=O)[C@@H](N)CC
|
C31H42N6O4 562.715000 |
ZOBWRGLXMKGVBQ-HOIWYFOJSA-N | P98170, Q13489 | Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM32598; PubChem:CID44237059
|
Local ready
Direct docking supported
|
|
E3L001592
BDB001592
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 38a
CC[C@H](N)C(=O)N[C@@H]1C(=O)N2[C@@H](CC[C@@H]1CNC(=O)NCc1ccccc1)CC[C@H]2C(=O)NC(c1ccccc1)c1ccccc1
|
C36H44N6O4 624.786000 |
IHWAHCOLVXAEFK-HVSNEVFASA-N | P98170, Q13489 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM32599; PubChem:CID44237060
|
Local ready
Direct docking supported
|
|
E3L001593
BDB001593
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 26c
CCNC(=S)NC[C@H]1CC[C@H]2CC[C@@H](C(=O)NC(c3ccccc3)c3ccccc3)N2C(=O)[C@H]1NC(=O)[C@@H](N)CC
|
C31H42N6O3S 578.783000 |
ICLOIEGJOKLZFR-HOIWYFOJSA-N | P98170, Q13489 | Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM32600; PubChem:CID44237061
|
Local ready
Direct docking supported
|
|
E3L001594
BDB001594
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 26d
CC[C@H](N)C(=O)N[C@@H]1C(=O)N2[C@@H](CC[C@@H]1CNC(=S)NCc1ccccc1)CC[C@H]2C(=O)NC(c1ccccc1)c1ccccc1
|
C36H44N6O3S 640.854000 |
BAMKYWPNUMTYIE-HVSNEVFASA-N | P98170, Q13489 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM32601; PubChem:CID44237062
|
Local ready
Direct docking supported
|
|
E3L001595
BDB001595
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 28a
CC[C@H](N)C(=O)N[C@@H]1C(=O)N2[C@@H](CC[C@@H]1CNC(N)=O)CC[C@H]2C(=O)NC(c1ccccc1)c1ccccc1
|
C29H38N6O4 534.661000 |
CLNSAWIZKPMBPV-FCRIMTMASA-N | P98170, Q13489 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM32602; PubChem:CID44237063
|
Local ready
Direct docking supported
|
|
E3L001596
BDB001596
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 28b
CC[C@H](N)C(=O)N[C@@H]1C(=O)N2[C@@H](CC[C@@H]1CNC(N)=S)CC[C@H]2C(=O)NC(c1ccccc1)c1ccccc1
|
C29H38N6O3S 550.729000 |
NOQRYBAHUHKPRC-FCRIMTMASA-N | P98170, Q13489 | Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM32603; PubChem:CID44237064
|
Local ready
Direct docking supported
|
|
E3L001597
BDB001597
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 31a
CC[C@H](N)C(=O)N[C@@H]1C(=O)N2[C@@H](CC[C@@H]1CC#N)CC[C@H]2C(=O)NC(c1ccccc1)c1ccccc1
|
C29H35N5O3 501.631000 |
LHNHJCMAMFMGRA-VEGWMBEDSA-N | P98170, Q13489 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM32604; PubChem:CID44237065
|
Local ready
Direct docking supported
|
|
E3L001598
BDB001598
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 32b
CC[C@H](NC)C(=O)N[C@@H]1C(=O)N2[C@@H](CC[C@@H]1CCN)CC[C@H]2C(=O)NC(c1ccccc1)c1ccccc1
|
C30H41N5O3 519.690000 |
NTMBSFPXIRJHSX-HOIWYFOJSA-N | P98170, Q13489 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM32605; PubChem:CID44237066
|
Local ready
Direct docking supported
|
|
E3L001599
BDB001599
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 34a
CC[C@H](N)C(=O)N[C@@H]1C(=O)N2[C@@H](CC[C@@H]1CCO)CC[C@H]2C(=O)NC(c1ccccc1)c1ccccc1
|
C29H38N4O4 506.647000 |
HAMADBKCKRFVNI-VEGWMBEDSA-N | P98170, Q13489 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM32606; PubChem:CID44237067
|
Local ready
Direct docking supported
|
|
E3L001600
BDB001600
|
1-Aza-2-oxobicyclo[5.3.0]decane scaffold, 34b
CC[C@H](NC)C(=O)N[C@@H]1C(=O)N2[C@@H](CC[C@@H]1CCO)CC[C@H]2C(=O)NC(c1ccccc1)c1ccccc1
|
C30H40N4O4 520.674000 |
BQFRGLYFTFQIFN-HOIWYFOJSA-N | P98170, Q13489 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM32607; PubChem:CID44237068
|
Local ready
Direct docking supported
|