| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L006981
BDB006981
|
BDBM156118
COC[C@H]1CN[C@H](C)CN1CC(=O)N1C[C@@](C)(COC)c2ccc(Br)cc21
|
C20H30BrN3O3 440.382000 |
RTVXFSDTIBQMQM-KKVAFCGZSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156118; PubChem:CID90232050
|
Local ready
Direct docking supported
|
|
E3L006982
BDB006982
|
BDBM156119
C[C@@H]1CN(CC(=O)N2CC(C)(C)c3ncc(Cc4ccccc4)cc32)[C@@H](C(=O)N(C)C)CN1
|
C26H35N5O2 449.599000 |
WVYSFJMJSGWZGD-XMSQKQJNSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM156119; PubChem:CID90232137
|
Local ready
Direct docking supported
|
|
E3L006983
BDB006983
|
BDBM156120
C[C@@H]1CN(CC(=O)N2CC(C)(C)c3ncc(Cc4ccccc4)cc32)[C@@H](Cn2cc(F)cn2)CN1
|
C27H33FN6O 476.600000 |
DBBWHLURUBJFKY-AUSIDOKSSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156120; PubChem:CID90232067
|
Local ready
Direct docking supported
|
|
E3L006984
BDB006984
|
BDBM156123
COC[C@H]1CN[C@H](C)CN1CC(=O)N1C[C@](C)(c2cc(C)no2)c2ccc(Cc3ccccc3)cc21
|
C29H36N4O3 488.632000 |
RAPRAYGBHMEHMH-OGQCEUPSSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156123; PubChem:CID71472619
|
Local ready
Direct docking supported
|
|
E3L006985
BDB006985
|
BDBM156124
COC[C@H]1CN[C@H](C)CN1CC(=O)N1C[C@@](C)(c2cc(C)no2)c2ccc(Cc3ccccc3)cc21
|
C29H36N4O3 488.632000 |
RAPRAYGBHMEHMH-RLACGHOJSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156124; PubChem:CID90231958
|
Local ready
Direct docking supported
|
|
E3L006986
BDB006986
|
BDBM156126
C[C@@H]1CN(CC(=O)N2CC(C)(C)c3cnc(Oc4ccccc4Cl)cc32)[C@@H](Cn2cc(F)cn2)CN1
|
C26H30ClFN6O2 513.017000 |
VCDOMHNTZJTKSU-IEBWSBKVSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156126; PubChem:CID90232065
|
Local ready
Direct docking supported
|
|
E3L006987
BDB006987
|
BDBM156129
C[C@@H]1CN(CC(=O)N2CC(C)(C)c3ncc(Cc4ccccc4)cc32)[C@@H](CN2CCCC2=O)CN1
|
C28H37N5O2 475.637000 |
ALAFRPAHGDJVFE-NFBKMPQASA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM156129; PubChem:CID90232154
|
Local ready
Direct docking supported
|
|
E3L006988
BDB006988
|
BDBM156130
COC[C@H]1CN[C@H](C)CN1CC(=O)N1CC(C)(C)c2cnc(C(C)(F)F)cc21
|
C20H30F2N4O2 396.482000 |
FEWFTJJRQQKWQV-ZIAGYGMSSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156130; PubChem:CID90232098
|
Local ready
Direct docking supported
|
|
E3L006989
BDB006989
|
BDBM156132
COC[C@H]1CN[C@H](C)CN1CC(=O)N1CC(C)(C)c2nnc(Cl)cc21
|
C17H26ClN5O2 367.881000 |
DEZXRKQOFXEUAK-VXGBXAGGSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM156132; PubChem:CID90232084
|
Local ready
Direct docking supported
|
|
E3L006990
BDB006990
|
BDBM156133
C[C@@H]1CN(CC(=O)N2CC(C)(C)c3cnc(C(C)(F)F)cc32)[C@@H](CN2CCCC2=O)CN1
|
C23H33F2N5O2 449.546000 |
YCUQOCWFEFYYDO-HZPDHXFCSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM156133; PubChem:CID90251861
|
Local ready
Direct docking supported
|
|
E3L006991
BDB006991
|
BDBM156134
C[C@@H]1CN(CC(=O)N2CC(C)(C)c3cnc(Cc4ccc(F)cc4F)cc32)[C@@H](Cn2cccnc2=O)CN1
|
C28H32F2N6O2 522.600000 |
SBBTWAINYJDSFH-XMSQKQJNSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156134; PubChem:CID90232011
|
Local ready
Direct docking supported
|
|
E3L006992
BDB006992
|
BDBM156135
CCC(F)(F)c1cnc2c(c1)N(C(=O)CN1C[C@@H](C)NC[C@@H]1CN1CCOC[C@H]1C)CC2(C)C
|
C25H39F2N5O2 479.616000 |
FGYXWHPIMSKBCD-QWFCFKBJSA-N | Q13490 | Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM156135; PubChem:CID90232252
|
Local ready
Direct docking supported
|
|
E3L006993
BDB006993
|
BDBM156136
C[C@@H]1CN(CC(=O)N2CC(C)(C)c3ncc(C(=O)c4ccccc4)cc32)[C@@H](CN2CCCC2=O)CN1
|
C28H35N5O3 489.620000 |
POAFWHYXMAWNRY-DENIHFKCSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM156136; PubChem:CID90231937
|
Local ready
Direct docking supported
|
|
E3L006994
BDB006994
|
BDBM156137
C[C@@H]1CN(CC(=O)N2CC(C)(C)c3ncc(C(C)(F)F)cc32)[C@@H](CN2CCCC2=O)CN1
|
C23H33F2N5O2 449.546000 |
ZWMYITSLGKMQCO-NVXWUHKLSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156137; PubChem:CID90232234
|
Local ready
Direct docking supported
|
|
E3L006995
BDB006995
|
BDBM156138
C[C@@H]1CN(CC(=O)N2CC(C)(C)c3cnc(Oc4ccccc4Cl)cc32)[C@@H](CN2CCOC2=O)CN1
|
C26H32ClN5O4 514.026000 |
JBYVFLDCBOXWPG-QZTJIDSGSA-N | Q13490 | Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM156138; PubChem:CID90232147
|
Local ready
Direct docking supported
|
|
E3L006996
BDB006996
|
BDBM156139
CCC(F)(F)c1cnc2c(c1)N(C(=O)CN1C[C@@H](C)NC[C@@H]1CN1CCCC1=O)CC2(C)C
|
C24H35F2N5O2 463.573000 |
PXEPLGSRYHWTKA-SJLPKXTDSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM156139; PubChem:CID90231969
|
Local ready
Direct docking supported
|
|
E3L006997
BDB006997
|
BDBM156140
C[C@@H]1CN(CC(=O)N2CC(C)(C)c3cnc(Cc4ccc(F)cc4F)cc32)[C@@H](CN2CCOCC2=O)CN1
|
C28H35F2N5O3 527.616000 |
RQMNGQJZIPKZMY-XMSQKQJNSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156140; PubChem:CID90232041
|
Local ready
Direct docking supported
|
|
E3L006998
BDB006998
|
BDBM156141
C[C@@H]1CN(CC(=O)N2CC(C)(C)c3cnc(Cc4ccc(F)cc4F)cc32)[C@@H](CN2CCCCC2=O)CN1
|
C29H37F2N5O2 525.644000 |
HKJYMEJFXJIWHQ-AUSIDOKSSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156141; PubChem:CID90232397
|
Local ready
Direct docking supported
|
|
E3L006999
BDB006999
|
BDBM156143
C[C@@H]1CN(CC(=O)N2CC(C)(C)c3cnc(Cc4ccc(F)cc4F)cc32)[C@@H](Cn2ncccc2=O)CN1
|
C28H32F2N6O2 522.600000 |
ZDWKYQCQVDXMQV-XMSQKQJNSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156143; PubChem:CID90232384
|
Local ready
Direct docking supported
|
|
E3L007000
BDB007000
|
BDBM156144
C[C@@H]1CN(CC(=O)N2CC(C)(C)c3cnc(Cc4ccc(F)cc4F)cc32)[C@@H](Cn2ccncc2=O)CN1
|
C28H32F2N6O2 522.600000 |
QAQCZKUWHKKFCT-XMSQKQJNSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM156144; PubChem:CID90232046
|
Local ready
Direct docking supported
|