| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L000181
BDB000181
|
BDBM13183
C[C@H](N)C(=O)Nc1nc2ccc(C(=O)c3ccccc3)cc2[nH]1
|
C17H16N4O2 308.341000 |
FEWJFTGPRLQQMU-JTQLQIEISA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM13183; PubChem:CID23646346
|
Local ready
Direct docking supported
|
|
E3L000182
BDB000182
|
BDBM13184
Cc1cc(-c2csc(NC(=O)[C@H](C)N)n2)ccc1Cl
|
C13H14ClN3OS 295.795000 |
ZNBPSBVGOOQAMX-QMMMGPOBSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM13184; PubChem:CID23644673
|
Local ready
Direct docking supported
|
|
E3L000183
BDB000183
|
BDBM13185
Cc1cc(C)c(Cc2[nH]c(NC(=O)[C@H](C)N)nc2C)c(C)c1
|
C17H24N4O 300.406000 |
HAPAZDKFFVFQSG-LBPRGKRZSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM13185; PubChem:CID23646347
|
Local ready
Direct docking supported
|
|
E3L000184
BDB000184
|
BDBM13186
Cc1sc(NC(=O)[C@H](C)N)nc1-c1ccccc1
|
C13H15N3OS 261.350000 |
YBJRXGCOAGWFHV-QMMMGPOBSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM13186; PubChem:CID23646348
|
Local ready
Direct docking supported
|
|
E3L000185
BDB000185
|
BDBM13187
C[C@H](N)C(=O)Nc1nc(-c2ccccc2)c(C(C)(C)C)s1
|
C16H21N3OS 303.431000 |
YDKNXEHODDDSPQ-JTQLQIEISA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM13187; PubChem:CID23646349
|
Local ready
Direct docking supported
|
|
E3L000186
BDB000186
|
BDBM13188
Cc1nc(NC(=O)[C@H](C)N)sc1-c1ccccc1
|
C13H15N3OS 261.350000 |
DKYHCWLDOYLCBN-QMMMGPOBSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM13188; PubChem:CID23646350
|
Local ready
Direct docking supported
|
|
E3L000187
BDB000187
|
BDBM13189
C[C@H](N)C(=O)Nc1nc(-c2ccccc2)c(-c2ccccc2)s1
|
C18H17N3OS 323.421000 |
ACAHAYSKCDTFST-LBPRGKRZSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM13189; PubChem:CID23646351
|
Local ready
Direct docking supported
|
|
E3L000188
BDB000188
|
BDBM13190
C[C@H](N)C(=O)Nc1nc(-c2ccc(Br)cc2)c(-c2ccccc2)s1
|
C18H16BrN3OS 402.317000 |
LETBSEIOGAQYDW-NSHDSACASA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM13190; PubChem:CID11429547
|
Local ready
Direct docking supported
|
|
E3L000189
BDB000189
|
BDBM13191
C[C@H](N)C(=O)Nc1nc(-c2ccc(Cc3ccccc3)cc2)c(-c2ccccc2)s1
|
C25H23N3OS 413.546000 |
NOAPVKQSSCRBKE-KRWDZBQOSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM13191; PubChem:CID23646352
|
Local ready
Direct docking supported
|
|
E3L000190
BDB000190
|
BDBM13192
C[C@H](N)C(=O)Nc1nc(-c2cccc(Cc3ccccc3)c2)c(Cc2ccccc2)s1
|
C26H25N3OS 427.573000 |
KXYXQGCPKXXFTP-SFHVURJKSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM13192; PubChem:CID23646353
|
Local ready
Direct docking supported
|
|
E3L000191
BDB000191
|
BDBM13193
C[C@H](N)C(=O)Nc1nc(COc2ccccc2)c(Cc2ccccc2)s1
|
C20H21N3O2S 367.474000 |
SNMREYXKHOXAHO-AWEZNQCLSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM13193; PubChem:CID23646354
|
Local ready
Direct docking supported
|
|
E3L000192
BDB000192
|
BDBM13194
C[C@H](N)C(=O)Nc1nc(COCc2ccccc2)c(Cc2ccccc2)s1
|
C21H23N3O2S 381.501000 |
YBRWIUWQAJGHRM-HNNXBMFYSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM13194; PubChem:CID23646355
|
Local ready
Direct docking supported
|
|
E3L000193
BDB000193
|
BDBM13195
C[C@H](N)C(=O)Nc1nc(COc2cccc3ccccc23)c(Cc2ccccc2)s1
|
C24H23N3O2S 417.534000 |
DHZMJXAYZVBSIS-INIZCTEOSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM13195; PubChem:CID23646356
|
Local ready
Direct docking supported
|
|
E3L000194
BDB000194
|
BDBM13196
C[C@H](N)C(=O)Nc1nc(COc2ccc3ccccc3c2)c(Cc2ccccc2)s1
|
C24H23N3O2S 417.534000 |
MHHSJWQWIXSVDO-INIZCTEOSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM13196; PubChem:CID23646357
|
Local ready
Direct docking supported
|
|
E3L000195
BDB000195
|
BDBM13197
C[C@H](N)C(=O)Nc1nc(COC2Cc3ccccc3C2)c(Cc2ccccc2)s1
|
C23H25N3O2S 407.539000 |
NJLCBCUEQWZJFS-HNNXBMFYSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM13197; PubChem:CID23646358
|
Local ready
Direct docking supported
|
|
E3L000196
BDB000196
|
BDBM13198
C[C@H](N)C(=O)Nc1nc2c(ccc3ccccc32)s1
|
C14H13N3OS 271.345000 |
POCGMBFIWVYGJC-QMMMGPOBSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM13198; PubChem:CID23646359
|
Local ready
Direct docking supported
|
|
E3L000197
BDB000197
|
BDBM13199
C[C@H](N)C(=O)Nc1nc2c(s1)CCc1ccccc1-2
|
C14H15N3OS 273.361000 |
DILLNEYKYRQUAB-QMMMGPOBSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM13199; PubChem:CID23646360
|
Local ready
Direct docking supported
|
|
E3L000198
BDB000198
|
L-Alanyl-L-valyl-L-prolyl-L-isoleucinamide
CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)N)C(C)C)C(N)=O
|
C19H35N5O4 397.520000 |
JHPFUTHPFNABKY-YTFOTSKYSA-N | P98170, Q13489, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM13200; PubChem:CID23646361
|
Local ready
Direct docking supported
|
|
E3L000199
BDB000199
|
BDBM13202
C[C@H](N)C(=O)N[C@H]1CC[C@H]2CC[C@@H](C(=O)NCc3ccccc3)N2C1=O
|
C19H26N4O3 358.442000 |
HRYYDNAJRUXAJE-TUUVXOQKSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM13202; PubChem:CID11326885
|
Local ready
Direct docking supported
|
|
E3L000200
BDB000200
|
BDBM13203
C[C@H](N)C(=O)N[C@H]1CC[C@@H]2CC[C@@H](C(=O)NCc3ccccc3)N2C1=O
|
C19H26N4O3 358.442000 |
HRYYDNAJRUXAJE-UKMLZYKCSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM13203; PubChem:CID11280887
|
Local ready
Direct docking supported
|