| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L056341
BDB056341
|
BDBM50441805
CN[C@@H](C)C(=O)N[C@H]1CN(C)c2ccccc2N(Cc2cccc3ccccc23)C1=O
|
C25H28N4O2 416.525000 |
SFOIEDLMYJHJGW-UWJYYQICSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441805; PubChem:CID72714293
|
Local ready
Direct docking supported
|
|
E3L056342
BDB056342
|
BDBM50441806
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(C)ccc3ccccc23)c2ccc(C#N)cc2N(C(C)=O)[C@H]1C
|
C29H31N5O3 497.599000 |
STBLNCCBQMHSRC-BATDWUPUSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441806; PubChem:CID72714058
|
Local ready
Direct docking supported
|
|
E3L056343
BDB056343
|
BDBM50441807
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(OC)ccc3ccccc23)c2ccc(C#N)cc2N(C(C)=O)[C@H]1C
|
C29H31N5O4 513.598000 |
HIFDPWOYCPYURM-VFUKXHBFSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441807; PubChem:CID72714054
|
Local ready
Direct docking supported
|
|
E3L056344
BDB056344
|
BDBM50441808
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(C)ccc3ccccc23)c2ccccc2N(C(=O)CS(C)(=O)=O)[C@H]1C
|
C29H34N4O5S 550.681000 |
PGECROXJANTNTJ-OSOCVKALSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441808; PubChem:CID72712133
|
Local ready
Direct docking supported
|
|
E3L056345
BDB056345
|
BDBM50441809
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(OC)ccc3ccccc23)c2ccccc2N(C(=O)CS(C)(=O)=O)[C@H]1C
|
C29H34N4O6S 566.680000 |
BGYFKRZCGFJTOF-BATDWUPUSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441809; PubChem:CID72712131
|
Local ready
Direct docking supported
|
|
E3L056346
BDB056346
|
BDBM50441810
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)CS(C)(=O)=O)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C28H31BrN4O6S 631.549000 |
ADRJVDXZPHWNKH-JTSKRJEESA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441810; PubChem:CID72711932
|
Local ready
Direct docking supported
|
|
E3L056347
BDB056347
|
BDBM50441811
CN[C@@H](C)C(=O)N[C@H]1CN(C(C)=O)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C27H29BrN4O4 553.457000 |
PBAVHKPUMOQYFD-AOMKIAJQSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441811; PubChem:CID72711930
|
Local ready
Direct docking supported
|
|
E3L056348
BDB056348
|
BDBM50441812
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C32H30BrN5O6 660.525000 |
MPBAYUHXOUYQBZ-SIBVEZHUSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441812; PubChem:CID72711485
|
Local ready
Direct docking supported
|
|
E3L056349
BDB056349
|
BDBM50441813
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2nn(-c3ccccc3C#N)c3ccccc23)c2ccccc2N(C(=O)CS(C)(=O)=O)[C@H]1C
|
C32H33N7O5S 627.727000 |
UMTKRFKKIISTSA-LPBFERMMSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM50441813
|
Local ready
Direct docking supported
|
|
E3L056350
BDB056350
|
BDBM50441814
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2nn(C)c3ccccc23)c2ccccc2N(C(=O)CS(C)(=O)=O)[C@H]1C
|
C26H32N6O5S 540.646000 |
NPXPHLKQAXBREH-UAVUOLJFSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441814; PubChem:CID72712344
|
Local ready
Direct docking supported
|
|
E3L056351
BDB056351
|
BDBM50441815
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2noc3ccccc23)c2ccccc2N(C(=O)CS(C)(=O)=O)[C@H]1C
|
C25H29N5O6S 527.603000 |
PKGJQJIJEUTAME-KXNSMUHISA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441815; PubChem:CID72712342
|
Local ready
Direct docking supported
|
|
E3L056352
BDB056352
|
BDBM50441816
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(N)cc2)c2ccccc2N(Cc2c(OC)ccc3ccccc23)C1=O
|
C32H33N5O4 551.647000 |
BXNIMYHZUMCTGM-FNZWTVRRSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441816; PubChem:CID71819719
|
Local ready
Direct docking supported
|
|
E3L056353
BDB056353
|
BDBM50441817
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2cccc(F)c2)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C32H30BrFN4O4 633.518000 |
BBDAMYDQPOZZEU-SIBVEZHUSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441817; PubChem:CID72711253
|
Local ready
Direct docking supported
|
|
E3L056354
BDB056354
|
BDBM50441818
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)C2CCOCC2)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C31H35BrN4O5 623.548000 |
IQUWZXYBQGCQKJ-DFBJGRDBSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441818; PubChem:CID72711928
|
Local ready
Direct docking supported
|
|
E3L056355
BDB056355
|
BDBM50441819
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2cccnc2)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C31H30BrN5O4 616.516000 |
RBSVEPCXJWZPIY-DFBJGRDBSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441819; PubChem:CID72711720
|
Local ready
Direct docking supported
|
|
E3L056356
BDB056356
|
BDBM50441820
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(C(C)=O)cc2)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C34H33BrN4O5 657.565000 |
VBKYKJZFJATBDB-MMTVBGGISA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441820; PubChem:CID72711483
|
Local ready
Direct docking supported
|
|
E3L056357
BDB056357
|
BDBM50441821
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(OC)ccc3ccccc23)c2ccc(C#N)cc2N(C(=O)CS(C)(=O)=O)[C@H]1C
|
C30H33N5O6S 591.690000 |
KAOBYIPCGFGNBY-CLWPXKJUSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM50441821
|
Local ready
Direct docking supported
|
|
E3L056358
BDB056358
|
BDBM50441823
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)CC(C)C)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C30H35BrN4O4 595.538000 |
RBYCERGIKPUFHO-CYFREDJKSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441823; PubChem:CID72711029
|
Local ready
Direct docking supported
|
|
E3L056359
BDB056359
|
BDBM50441824
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(C)ccc3ccccc23)c2ccc(C#N)cc2N(C(=O)CS(C)(=O)=O)[C@H]1C
|
C30H33N5O5S 575.691000 |
JQUOOERRWMBNQL-JVAKCPTJSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM50441824
|
Local ready
Direct docking supported
|
|
E3L056360
BDB056360
|
BDBM50441825
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccccc2F)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C32H30BrFN4O4 633.518000 |
AZUWGFNMKLGVNC-SIBVEZHUSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441825; PubChem:CID72711255
|
Local ready
Direct docking supported
|