| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L015281
BDB015281
|
US9783573, Example 9
CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(NC(=O)c3ccc(CCC(=O)N[C@H]4C[C@@H](C(=O)N[C@@H]5CCCc6ccccc65)N(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C4)cc3)ccc2C[C@H]1C(=O)N[C@@H]1CCCc2ccccc21)C(C)(C)C
|
C65H86N10O8 1135.465000 |
HBAIJECFJKLGEI-YKAQSNEXSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM345159; PubChem:CID73506218
|
Local ready
Direct docking supported
|
|
E3L015282
BDB015282
|
US9783573, Example 11
CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(NC(=O)c3ccc(C(=O)N[C@H]4C[C@@H](C(=O)NC5CCCc6ccccc65)N(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C4)cc3)ccc2C[C@H]1C(=O)NC(C)c1ccccc1F)C(C)(C)C
|
C61H79FN10O8 1099.363000 |
PFUPNPPJJNJCGN-BWJQVGBUSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM345161; PubChem:CID118504449
|
Local ready
Direct docking supported
|
|
E3L015283
BDB015283
|
US9783573, Example 12
CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(NC(=O)c3ccc(C(=O)Nc4ccc5c(c4)CN(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)[C@H](C(=O)NC(C)c4ccccc4F)C5)cc3)ccc2C[C@H]1C(=O)NC(C)c1ccccc1F)C(C)(C)C
|
C64H78F2N10O8 1153.386000 |
HCIJWALQGPLBEB-XMVXTKETSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM345162; PubChem:CID138961776
|
Local ready
Direct docking supported
|
|
E3L015284
BDB015284
|
US9783573, Example 13
CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(NC(=O)c3ccc(C(=O)N[C@H]4C[C@@H](C(=O)NC5CCCc6ccccc65)N(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C4)cc3)ccc2C[C@H]1C(=O)NC(COC)c1ccccc1)C(C)(C)C
|
C62H82N10O9 1111.399000 |
BHASZCHHIQDISV-SMLDLAEESA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM345163; PubChem:CID118504450
|
Local ready
Direct docking supported
|
|
E3L015285
BDB015285
|
US9783573, Example 14
CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(NC(=O)c3ccc(C(=O)Nc4ccc5c(c4)CN(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)[C@H](C(=O)NC(COC)c4ccccc4)C5)cc3)ccc2C[C@H]1C(=O)NC(COC)c1ccccc1)C(C)(C)C
|
C66H84N10O10 1177.458000 |
XPTXHABMKLUTIY-KBAUTRCZSA-N | P98170, Q13489, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM345164; PubChem:CID138961777
|
Local ready
Direct docking supported
|
|
E3L015286
BDB015286
|
US9783573, Example 15
CC[C@H](NC)C(=O)N[C@H](C(=O)N1Cc2cc(NC(=O)c3ccc(C(=O)N[C@H]4C[C@@H](C(=O)NC5CCCc6ccccc65)N(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C4)cc3)ccc2C[C@H]1C(=O)NC1CCCc2ccccc21)C(C)(C)C
|
C64H84N10O8 1121.438000 |
WYXHJJMQPDPGGU-HTCNLZEBSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM345165; PubChem:CID118504451
|
Local ready
Direct docking supported
|
|
E3L015287
BDB015287
|
US9783573, Example 16
CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(NC(=O)C(F)(F)C(F)(F)C(F)(F)C(=O)N[C@H]3C[C@@H](C(=O)NC4CCCc5ccccc54)N(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C3)ccc2C[C@H]1C(=O)NC1CCCc2ccccc21)C(C)(C)C
|
C60H78F6N10O8 1181.334000 |
QPEYDHPWFLBNLA-PQZODOBESA-N | P98170, Q13489, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM345166; PubChem:CID138961778
|
Local ready
Direct docking supported
|
|
E3L015288
BDB015288
|
US9783573, Example 17
CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(NC(=O)C(F)(F)C(F)(F)C(=O)N[C@H]3C[C@@H](C(=O)NC4CCCc5ccccc54)N(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C3)ccc2C[C@H]1C(=O)NC1CCCc2ccccc21)C(C)(C)C
|
C59H78F4N10O8 1131.327000 |
KAHNQMZNNBFFEQ-PQZODOBESA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM345167; PubChem:CID138961779
|
Local ready
Direct docking supported
|
|
E3L015289
BDB015289
|
US9783573, Example 18
CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(NC(=O)N[C@H]3C[C@@H](C(=O)NC4CCCc5ccccc54)N(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C3)ccc2C[C@H]1C(=O)NC1CCCc2ccccc21)C(C)(C)C
|
C56H78N10O7 1003.303000 |
HEUQZEJFJZTMAR-PQZODOBESA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM345168; PubChem:CID138961780
|
Local ready
Direct docking supported
|
|
E3L015290
BDB015290
|
US9783573, Example 19
CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(NCC(=O)N[C@H]3C[C@@H](C(=O)NC4CCCc5ccccc54)N(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C3)ccc2C[C@H]1C(=O)NC1CCCc2ccccc21)C(C)(C)C
|
C57H80N10O7 1017.330000 |
GPKBDHHTTCGIAO-QSPBPXMSSA-N | P98170, Q13489, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM345169; PubChem:CID138961781
|
Local ready
Direct docking supported
|
|
E3L015291
BDB015291
|
US9783573, Example 20
CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(C(=O)Nc3nc4cc(C(=O)N[C@H]5C[C@@H](C(=O)NC6CCCc7ccccc76)N(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C5)ccc4s3)ccc2C[C@H]1C(=O)NC1CCCc2ccccc21)C(C)(C)C
|
C64H81N11O8S 1164.488000 |
SYZOGRWMVSXFBX-FLZZYPNDSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM345170; PubChem:CID138961782
|
Local ready
Direct docking supported
|
|
E3L015292
BDB015292
|
US9783573, Example 21
CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(C(=O)Nc3ncc(C(=O)N[C@H]4C[C@@H](C(=O)N[C@@H]5CCCc6ccccc65)N(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C4)s3)ccc2C[C@H]1C(=O)N[C@@H]1CCCc2ccccc21)C(C)(C)C
|
C60H79N11O8S 1114.428000 |
RJXWMKIKKCMBFT-QLYDQGARSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM345171; PubChem:CID73507095
|
Local ready
Direct docking supported
|
|
E3L015293
BDB015293
|
US9783573, Example 22
CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(C(=O)Nc3nc(C(=O)N[C@H]4C[C@@H](C(=O)N[C@@H]5CCCc6ccccc65)N(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C4)co3)ccc2C[C@H]1C(=O)N[C@@H]1CCCc2ccccc21)C(C)(C)C
|
C60H79N11O9 1098.360000 |
WZONVNDJZGEOPI-FRSYPQKNSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM345172; PubChem:CID73507317
|
Local ready
Direct docking supported
|
|
E3L015294
BDB015294
|
US9783573, Example 24
CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(C(=O)Nc3ccc4cc(C(=O)N[C@H]5C[C@@H](C(=O)N[C@@H]6CCCc7ccccc76)N(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C5)[nH]c4c3)ccc2C[C@H]1C(=O)N[C@@H]1CCCc2ccccc21)C(C)(C)C
|
C65H83N11O8 1146.448000 |
OZBQKKNFAFJMFT-VZMWKORWSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM345174; PubChem:CID118497889
|
Local ready
Direct docking supported
|
|
E3L015295
BDB015295
|
US9783573, Example 25
CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(C(=O)NCc3ccc(C(=O)N[C@H]4C[C@@H](C(=O)N[C@@H]5CCCc6ccccc65)N(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C4)cn3)ccc2C[C@H]1C(=O)N[C@@H]1CCCc2ccccc21)C(C)(C)C
|
C63H83N11O8 1122.426000 |
XZJCEISXWHYZEG-UPKUDDMJSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM345175; PubChem:CID73504105
|
Local ready
Direct docking supported
|
|
E3L015296
BDB015296
|
US9783573, Example 26
CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(C(=O)Nc3ncnn4cc(C(=O)N[C@H]5C[C@@H](C(=O)N[C@@H]6CCCc7ccccc76)N(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C5)c(C)c34)ccc2C[C@H]1C(=O)N[C@@H]1CCCc2ccccc21)C(C)(C)C
|
C64H83N13O8 1162.451000 |
LVOPBJNMNTXXAB-XROZKOHISA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM345176; PubChem:CID118497966
|
Local ready
Direct docking supported
|
|
E3L015297
BDB015297
|
US9783573, Example 27
CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(C(=O)Nc3ccc(C(=O)NC4C[C@@H](C(=O)NC5CCCc6ccccc65)N(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C4)cc3)ccc2C[C@H]1C(=O)NC1CCCc2ccccc21)C(C)(C)C
|
C63H82N10O8 1107.411000 |
USERKMPOWCIHLQ-WTXFRZPCSA-N | P98170, Q13489, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM345177; PubChem:CID138961783
|
Local ready
Direct docking supported
|
|
E3L015298
BDB015298
|
US9783573, Example 28
CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(C(=O)NC3(C(=O)N[C@H]4C[C@@H](C(=O)N[C@@H]5CCCc6ccccc65)N(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C4)CC3)ccc2C[C@H]1C(=O)N[C@@H]1CCCc2ccccc21)C(C)(C)C
|
C60H82N10O8 1071.378000 |
UEANYVMOHVPPNC-LPWRHJBZSA-N | P98170, Q13489, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM345178; PubChem:CID73504106
|
Local ready
Direct docking supported
|
|
E3L015299
BDB015299
|
US9783573, Example 29
CN[C@@H](C)C(=O)N[C@H](C(=O)N1Cc2cc(C(=O)NC(C)(C)C(=O)N[C@H]3C[C@@H](C(=O)N[C@@H]4CCCc5ccccc54)N(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C3)ccc2C[C@H]1C(=O)N[C@@H]1CCCc2ccccc21)C(C)(C)C
|
C60H84N10O8 1073.394000 |
USRMQGZFCDUGRL-LPWRHJBZSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM345179; PubChem:CID118497878
|
Local ready
Direct docking supported
|
|
E3L015300
BDB015300
|
US9783573, Example 30
CN[C@@H](C)C(=O)N[C@H](C(=O)N1CC[C@@H](OCc2ccc(C(=O)NC3C[C@@H](C(=O)NC4CCCc5ccccc54)N(C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C)C3)cc2)C[C@H]1C(=O)NC1CCCc2ccccc21)C(C)(C)C
|
C59H83N9O8 1046.368000 |
CPBUAUBYAKLKOK-HAHYJMHBSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM345180; PubChem:CID138961784
|
Local ready
Direct docking supported
|