| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L011501
BDB011501
|
BDBM237619
CN[C@@H](C)C(=O)N[C@H]1COc2ccccc2N(Cc2c(OC)ccc3cc(C(=O)OC)ccc23)C1=O
|
C27H29N3O6 491.544000 |
XVRXCRGYPZBSBD-KKSFZXQISA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237619; PubChem:CID73058107
|
Local ready
Direct docking supported
|
|
E3L011502
BDB011502
|
BDBM237620
CN[C@@H](C)C(=O)N[C@H]1COc2ccccc2N(Cc2c(OC)ccc3cc(C(=O)O)ccc23)C1=O
|
C26H27N3O6 477.517000 |
FXWNXUAVASQHNP-YWZLYKJASA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237620; PubChem:CID73053728
|
Local ready
Direct docking supported
|
|
E3L011503
BDB011503
|
BDBM237621
CN[C@@H](C)C(=O)N[C@H]1COc2ccccc2N(Cc2c(OC)ccc3cc(C(=O)N(C)CCO)ccc23)C1=O
|
C29H34N4O6 534.613000 |
MFDWMOLYSMLKHS-MBSDFSHPSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237621; PubChem:CID118586168
|
Local ready
Direct docking supported
|
|
E3L011504
BDB011504
|
BDBM237622
CN[C@@H](C)C(=O)N[C@H]1COc2ccccc2N(Cc2c(OC)ccc3cc(C(=O)NCCC(=O)O)ccc23)C1=O
|
C29H32N4O7 548.596000 |
XLZZZYCPXCAWJQ-JTSKRJEESA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237622; PubChem:CID118586143
|
Local ready
Direct docking supported
|
|
E3L011505
BDB011505
|
BDBM237623
CN[C@@H](C)C(=O)N[C@H]1COc2ccccc2N(Cc2c(OC)ccc3cc(C(=O)N(C)C)ccc23)C1=O
|
C28H32N4O5 504.587000 |
XIAPFVQCGJJDLL-JTSKRJEESA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237623; PubChem:CID90060696
|
Local ready
Direct docking supported
|
|
E3L011506
BDB011506
|
BDBM237624
CN[C@@H](C)C(=O)N[C@H]1COc2cc(C)ccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C26H28BrN3O4 526.431000 |
SIOLYMCSTIOYGU-KKSFZXQISA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237624; PubChem:CID90060626
|
Local ready
Direct docking supported
|
|
E3L011507
BDB011507
|
BDBM237625
COc1ccc2cc(Br)ccc2c1CN1C(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)COc2cc(C)ccc21
|
C26H28BrN3O5 542.430000 |
GJHQSQQUFJDDTR-VNOPPTIDSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237625; PubChem:CID90060723
|
Local ready
Direct docking supported
|
|
E3L011508
BDB011508
|
BDBM237626
COc1ccc2cc(Br)ccc2c1CN1C(=O)[C@@H](NC(=O)[C@@H](N)[C@H](C)O)COc2cc(C)ccc21
|
C26H28BrN3O5 542.430000 |
GJHQSQQUFJDDTR-CCQPRUGESA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237626; PubChem:CID90060699
|
Local ready
Direct docking supported
|
|
E3L011509
BDB011509
|
BDBM237627
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(OC)ccc3cc(Br)ccc23)c2ccc(C)cc2O[C@H]1C
|
C27H30BrN3O4 540.458000 |
XYXKAUGBKYDYDB-TZPNTHKFSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237627; PubChem:CID73054024
|
Local ready
Direct docking supported
|
|
E3L011510
BDB011510
|
BDBM237628
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(OC)ccc3cc(C(=O)OC)ccc23)c2ccc(C)cc2O[C@H]1C
|
C29H33N3O6 519.598000 |
GLMYCUJMYACUKQ-XWXLMPLOSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237628; PubChem:CID73054292
|
Local ready
Direct docking supported
|
|
E3L011511
BDB011511
|
BDBM237629
CN[C@H](C(=O)N[C@@H]1C(=O)N(Cc2c(OC)ccc3cc(Br)ccc23)c2ccc(C)cc2O[C@H]1C)[C@H](C)O
|
C28H32BrN3O5 570.484000 |
LKIFTWKEGXUQGG-FRSFCCSCSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237629; PubChem:CID90060725
|
Local ready
Direct docking supported
|
|
E3L011512
BDB011512
|
BDBM237630
CN[C@@H](C)C(=O)N[C@H]1COc2ccc(C(F)(F)F)cc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C26H25BrF3N3O4 580.401000 |
JQVJYOMQBVYRMG-XOBRGWDASA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237630; PubChem:CID73054296
|
Local ready
Direct docking supported
|
|
E3L011513
BDB011513
|
BDBM237631
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(OC)ccc3cc(Br)ccc23)c2cc(C(F)(F)F)ccc2O[C@H]1C
|
C27H27BrF3N3O4 594.428000 |
OALZJUACHCHIBD-ISQRANHSSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237631; PubChem:CID73054298
|
Local ready
Direct docking supported
|
|
E3L011514
BDB011514
|
BDBM237632
CN[C@@H](C)C(=O)N[C@H]1COc2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C25H27N3O3 417.509000 |
PMTGJZLNFRQBBN-UWJYYQICSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237632; PubChem:CID73054588
|
Local ready
Direct docking supported
|
|
E3L011515
BDB011515
|
BDBM237633
CN[C@@H](C)C(=O)N[C@H]1COc2ccccc2N(Cc2ccccc2Cl)C1=O
|
C20H22ClN3O3 387.867000 |
GIKBDINPWKIYJA-BBRMVZONSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237633; PubChem:CID73054589
|
Local ready
Direct docking supported
|
|
E3L011516
BDB011516
|
BDBM237634
CN[C@@H](C)C(=O)N[C@H]1COc2ccccc2N(Cc2cccc(Cl)c2)C1=O
|
C20H22ClN3O3 387.867000 |
PQRLHLPVCHREAB-BBRMVZONSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237634; PubChem:CID73054590
|
Local ready
Direct docking supported
|
|
E3L011517
BDB011517
|
BDBM237635
CN[C@@H](C)C(=O)N[C@H]1COc2ccccc2N(Cc2ccc(Cl)cc2)C1=O
|
C20H22ClN3O3 387.867000 |
NZGXRNHLIKDWHR-BBRMVZONSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237635; PubChem:CID73054591
|
Local ready
Direct docking supported
|
|
E3L011518
BDB011518
|
BDBM237636
CN[C@@H](C)C(=O)N[C@H]1COc2c(C(=O)O)cccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C26H26BrN3O6 556.413000 |
RLXORJZNFQJZRM-XOBRGWDASA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237636; PubChem:CID73054593
|
Local ready
Direct docking supported
|
|
E3L011519
BDB011519
|
BDBM237637
CN[C@@H](C)C(=O)N[C@H]1COc2c(C(=O)O)cccc2N(Cc2c(OC)ccc3ccccc23)C1=O
|
C26H27N3O6 477.517000 |
USEHOLSOYKSOSD-YWZLYKJASA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237637; PubChem:CID73057219
|
Local ready
Direct docking supported
|
|
E3L011520
BDB011520
|
BDBM237638
CN[C@@H](C)C(=O)N[C@H]1COc2c(C(=O)NCCC(=O)O)cccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C29H31BrN4O7 627.492000 |
QXWFRZXIEMDIMN-AOMKIAJQSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM237638
|
Local ready
Direct docking supported
|