| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L006941
BDB006941
|
BDBM156076
COC[C@H]1CN[C@H](C)CN1CC(=O)N1CC(C)(COC)c2ccc(Br)cc21
|
C20H30BrN3O3 440.382000 |
RTVXFSDTIBQMQM-BISUUYRGSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM156076; PubChem:CID90232076
|
Local ready
Direct docking supported
|
|
E3L006942
BDB006942
|
BDBM156077
COC[C@H]1CN[C@H](C)CN1CC(=O)N1CC(C)(C)c2cnc(Oc3c(F)cccc3F)cc21
|
C24H30F2N4O3 460.525000 |
YTBHBPZHDPXCRD-HZPDHXFCSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156077; PubChem:CID90231994
|
Local ready
Direct docking supported
|
|
E3L006943
BDB006943
|
BDBM156078
COC[C@H]1CN[C@H](C)CN1CC(=O)N1CC(C)(C(=O)OC)c2ccc(Br)cc21
|
C20H28BrN3O4 454.365000 |
BFSDDFGNKDTSER-PJVSSZTGSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM156078; PubChem:CID90251767
|
Local ready
Direct docking supported
|
|
E3L006944
BDB006944
|
BDBM156079
COC[C@H]1CN[C@H](C)CN1CC(=O)N1CC(C)(C)c2cnc(Oc3c(C)cccc3Cl)cc21
|
C25H33ClN4O3 473.017000 |
TXRAJIRLJYXENI-QZTJIDSGSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM156079; PubChem:CID90232008
|
Local ready
Direct docking supported
|
|
E3L006945
BDB006945
|
BDBM156080
C[C@@H]1CN(CC(=O)N2CC(C)(C)c3cnc(Cc4ccccc4)cc32)[C@@H](C(=O)N2CCCC2)CN1
|
C28H37N5O2 475.637000 |
BETXVAXDXRXULO-CJFMBICVSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156080; PubChem:CID90232429
|
Local ready
Direct docking supported
|
|
E3L006946
BDB006946
|
BDBM156081
COC[C@H]1CN[C@H](C)CN1CC(=O)N1CC(C)(C)c2cnc(C(OC)c3ccccc3)cc21
|
C26H36N4O3 452.599000 |
KRJJPVPEYPGKSM-DUTPZCPISA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156081; PubChem:CID90232206
|
Local ready
Direct docking supported
|
|
E3L006947
BDB006947
|
BDBM156082
C[C@@H]1CN(CC(=O)N2CC(C)(C)c3cnc(Cc4ccccc4)cc32)[C@@H](C(=O)N2CCCCC2)CN1
|
C29H39N5O2 489.664000 |
XDWDCBMRYQGDMQ-QFQXNSOFSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156082; PubChem:CID90232222
|
Local ready
Direct docking supported
|
|
E3L006948
BDB006948
|
BDBM156083
COC[C@H]1CN[C@H](C)CN1CC(=O)N1CC(C)(C)c2cc(C)c(C#N)cc21
|
C21H30N4O2 370.497000 |
ZYWNTIVOMFMRMA-NVXWUHKLSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM156083; PubChem:CID90231916
|
Local ready
Direct docking supported
|
|
E3L006949
BDB006949
|
BDBM156084
CCC1(CC)CN(C(=O)CN2C[C@@H](C)NC[C@@H]2C(=O)N2CCOCC2)c2cc(Cl)ccc21
|
C24H35ClN4O3 463.022000 |
IUZLLIZGTHURNH-DYESRHJHSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156084; PubChem:CID90232240
|
Local ready
Direct docking supported
|
|
E3L006950
BDB006950
|
BDBM156085
COC[C@H]1CN[C@H](C)CN1CC(=O)N1CC(C)(c2ccccc2)c2ccc(C#N)cc21
|
C25H30N4O2 418.541000 |
DYXVCQMOKHZKMO-LCHCQGBESA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156085; PubChem:CID90232002
|
Local ready
Direct docking supported
|
|
E3L006951
BDB006951
|
BDBM156086
COC[C@H]1CN[C@H](C)CN1CC(=O)N1CC(C)(C)c2ncc(Cc3ccccc3)cc21
|
C25H34N4O2 422.573000 |
HHAFFIKQZNSDIS-WIYYLYMNSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM156086; PubChem:CID90231909
|
Local ready
Direct docking supported
|
|
E3L006952
BDB006952
|
BDBM156087
C[C@@H]1CN(CC(=O)N2CC(C)(C)c3ccc(Cl)cc32)[C@@H](Cn2cccn2)CN1
|
C21H28ClN5O 401.942000 |
YLKLZAKFJBUREM-NVXWUHKLSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM156087; PubChem:CID90232249
|
Local ready
Direct docking supported
|
|
E3L006953
BDB006953
|
BDBM156088
COC[C@H]1CN[C@H](C)CN1CC(=O)N1C[C@@](C)(c2ccccc2)c2ccc(C#N)cc21
|
C25H30N4O2 418.541000 |
DYXVCQMOKHZKMO-JYMRHQFYSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156088; PubChem:CID90232433
|
Local ready
Direct docking supported
|
|
E3L006954
BDB006954
|
BDBM156089
COC[C@H]1CN[C@H](C)CN1CC(=O)N1C[C@](C)(c2ccccc2)c2ccc(C#N)cc21
|
C25H30N4O2 418.541000 |
DYXVCQMOKHZKMO-IOZGHAEBSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156089; PubChem:CID90232151
|
Local ready
Direct docking supported
|
|
E3L006955
BDB006955
|
BDBM156090
COC[C@H]1CN[C@H](C)CN1CC(=O)N1CC(C)(C)c2cc(-c3nc(C)no3)c(Cl)cc21
|
C22H30ClN5O3 447.967000 |
DOIDMZYZVQDNOP-UKRRQHHQSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156090; PubChem:CID90232207
|
Local ready
Direct docking supported
|
|
E3L006956
BDB006956
|
BDBM156091
C[C@@H]1CN(CC(=O)N2CC3(Cc4ccccc4C3)c3ccc(Cl)cc32)[C@@H](Cn2cccn2)CN1
|
C27H30ClN5O 476.024000 |
FBGDHQDJRNFVPP-AUSIDOKSSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156091; PubChem:CID90232267
|
Local ready
Direct docking supported
|
|
E3L006957
BDB006957
|
BDBM156092
C[C@@H]1CN(CC(=O)N2CC(C)(c3ccccc3)c3ccc(C#N)cc32)[C@@H](Cn2cccn2)CN1
|
C27H30N6O 454.578000 |
QVLZUJSECVNNFP-LRUAEPSQSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM156092; PubChem:CID90232039
|
Local ready
Direct docking supported
|
|
E3L006958
BDB006958
|
BDBM156093
COC[C@H]1CN[C@H](C)CN1CC(=O)N1CC(C)(c2ccccn2)c2ccc(Cc3ccccc3)cc21
|
C30H36N4O2 484.644000 |
BRXOGCRNHUNLRA-MDQZGBPDSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM156093; PubChem:CID90232230
|
Local ready
Direct docking supported
|
|
E3L006959
BDB006959
|
BDBM156094
COC[C@H]1CN[C@H](C)CN1CC(=O)N1CC(C)(C)c2cnc(-c3ccoc3)cc21
|
C22H30N4O3 398.507000 |
TUDDXSKHXFBDBC-NVXWUHKLSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156094; PubChem:CID90231992
|
Local ready
Direct docking supported
|
|
E3L006960
BDB006960
|
BDBM156095
COC[C@H]1CN[C@H](C)CN1CC(=O)N1CC(C)(C)c2cnc(C(F)(F)c3ccccc3)cc21
|
C25H32F2N4O2 458.553000 |
FVANSFICGSEICP-IEBWSBKVSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM156095; PubChem:CID90232006
|
Local ready
Direct docking supported
|