| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L011741
BDB011741
|
BDBM241701
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)OC)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C27H30N4O4 474.561000 |
DRJYXRCWKFVLTM-AVRDEDQJSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM241701
|
Local ready
Direct docking supported
|
|
E3L011742
BDB011742
|
BDBM242408
COc1ccc2ccccc2c1CN1C(=O)C(NC(=O)[C@H](C)N)C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc21
|
C35H40N4O4 580.729000 |
FLYPMMIOPVMWBS-LWMOJHMESA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM242408; PubChem:CID122531539
|
Local ready
Direct docking supported
|
|
E3L011743
BDB011743
|
BDBM242579
CN[C@@H](C)C(=O)N[C@H]1CN2C(=O)CCCN(C)C(=O)c3ccc4c(c(OC)ccc4c3)CN(C1=O)c1ccccc12
|
C31H35N5O5 557.651000 |
RTKCXJJVDINMFF-CYFREDJKSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242579
|
Local ready
Direct docking supported
|
|
E3L011744
BDB011744
|
BDBM242580
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)CC(C)C)c2ccccc2N(Cc2ccccc2OC)C1=O
|
C26H34N4O4 466.582000 |
HUSFXTPAUXUGAL-ICSRJNTNSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM242580; PubChem:CID118086576
|
Local ready
Direct docking supported
|
|
E3L011745
BDB011745
|
BDBM242581
CC[C@H](NC)C(=O)NC1C(=O)N(Cc2c(OC)ccc3ccccc23)c2ccccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O
|
C37H44N4O4 608.783000 |
VFSUZEYGCPPYKQ-QAZDTREQSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM242581; PubChem:CID122531436
|
Local ready
Direct docking supported
|
|
E3L011746
BDB011746
|
BDBM242583
CC[C@H](NC)C(=O)NC1C(=O)N(C)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C27H30N4O3 458.562000 |
DESGHHDJGPNBIT-XEGCMXMBSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM242583; PubChem:CID122531412
|
Local ready
Direct docking supported
|
|
E3L011747
BDB011747
|
BDBM242585
CC[C@H](NC)C(=O)NC1C(=O)N(Cc2c(C)ccc3ccccc23)c2ccccc2N(c2ccccc2)C1=O
|
C32H32N4O3 520.633000 |
WQTWHRXSRYKUOM-QUWDGAPNSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM242585; PubChem:CID118076750
|
Local ready
Direct docking supported
|
|
E3L011748
BDB011748
|
BDBM242587
CN[C@@H](C)C(=O)NC1C(=O)N(Cc2c(C)ccc3ccccc23)c2ccccc2N(c2ccccc2)C1=O
|
C31H30N4O3 506.606000 |
SDKJKQSILYPXOB-QDLLFRBVSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM242587; PubChem:CID118077103
|
Local ready
Direct docking supported
|
|
E3L011749
BDB011749
|
BDBM242589
CN[C@@H](C)C(=O)N[C@H]1CN(S(=O)(=O)c2ccc(N)cc2)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C31H33N5O4S 571.703000 |
DWRWKRQFTZPNIE-IDISGSTGSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM242589; PubChem:CID122531396
|
Local ready
Direct docking supported
|
|
E3L011750
BDB011750
|
BDBM242590
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)CCCC(C)=O)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C31H35BrN4O5 623.548000 |
ASFSQLSTKRLNRZ-CPJSRVTESA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242590
|
Local ready
Direct docking supported
|
|
E3L011751
BDB011751
|
BDBM242591
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2cccc(C(C)O)c2)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C34H36N4O4 564.686000 |
HPCMPJMRVFYGCF-PIZRKSBESA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242591
|
Local ready
Direct docking supported
|
|
E3L011752
BDB011752
|
BDBM242592
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(C(=O)OC)cc2)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C34H33BrN4O6 673.564000 |
SXOWGVPZRLSEAF-DCFHFQCYSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242592
|
Local ready
Direct docking supported
|
|
E3L011753
BDB011753
|
BDBM242594
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(C(=O)O)cc2)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C33H31BrN4O6 659.537000 |
KICGBGWJSBMWAK-SIBVEZHUSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242594
|
Local ready
Direct docking supported
|
|
E3L011754
BDB011754
|
BDBM242595
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(C(C)=O)cc2)c2ccccc2N(Cc2nn(-c3ccccc3C#N)c3ccccc23)C1=O
|
C37H33N7O4 639.716000 |
IBHPLEGIMMIZAQ-JHOBJCJYSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242595
|
Local ready
Direct docking supported
|
|
E3L011755
BDB011755
|
BDBM242596
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(C(N)=O)cc2)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C33H32BrN5O5 658.553000 |
JFONEQSYAHTTGI-SIBVEZHUSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242596
|
Local ready
Direct docking supported
|
|
E3L011756
BDB011756
|
BDBM242597
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(N)cc2)c2cc(Cl)ccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C32H32ClN5O3 570.093000 |
NYASEDZUZJHFTL-DCFHFQCYSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242597
|
Local ready
Direct docking supported
|
|
E3L011757
BDB011757
|
BDBM242598
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(C(=O)NCC3CCCCC3)cc2)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C40H44BrN5O5 754.726000 |
OQSLFGBQSWACBU-JQJBXXCASA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242598
|
Local ready
Direct docking supported
|
|
E3L011758
BDB011758
|
BDBM242599
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(N)cc2)c2cc(Cl)ccc2N(Cc2c(OC)ccc3ccccc23)C1=O
|
C32H32ClN5O4 586.092000 |
PYGGARGXJMZFPP-SIBVEZHUSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242599
|
Local ready
Direct docking supported
|
|
E3L011759
BDB011759
|
BDBM242600
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(C(O)C(F)(F)F)cc2)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C34H32BrF3N4O5 713.551000 |
HLVZIUNUMSNQFS-SIPNUGOWSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242600
|
Local ready
Direct docking supported
|
|
E3L011760
BDB011760
|
BDBM242601
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(N)cc2)c2cc(Cl)ccc2N(Cc2c(OC)ccc3c(Br)cccc23)C1=O
|
C32H31BrClN5O4 664.988000 |
ZPWXNJPAHZEINN-QYBDOPJKSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242601
|
Local ready
Direct docking supported
|