| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L011461
BDB011461
|
BDBM237578
CN[C@@H](C)C(=O)N[C@H]1C(=O)N(Cc2c(OC)ccc3cc(Br)ccc23)c2ccccc2O[C@@]12CCOC2
|
C28H30BrN3O5 568.468000 |
HELQGTDTITZVDX-JGXREDOWSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237578; PubChem:CID90060712
|
Local ready
Direct docking supported
|
|
E3L011462
BDB011462
|
BDBM237579
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(OC)ccc3cc(Br)ccc23)c2ccccc2O[C@@]12CCOC2
|
C28H30BrN3O5 568.468000 |
HELQGTDTITZVDX-VVTZZXDESA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237579; PubChem:CID118586138
|
Local ready
Direct docking supported
|
|
E3L011463
BDB011463
|
BDBM237581
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(OC)ccc3c(Br)cccc23)c2ccccc2OC12CCOCC2
|
C29H32BrN3O5 582.495000 |
DHCRJEINPCNUPE-HFJWLAOPSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237581; PubChem:CID118586141
|
Local ready
Direct docking supported
|
|
E3L011464
BDB011464
|
BDBM237582
CN[C@@H](C)C(=O)N[C@@H]1CC(Cc2c(OC)ccc3c(Br)cccc23)c2ccccc2O[C@H]1C
|
C27H31BrN2O3 511.460000 |
MHMYSLLSJNMCBF-BQLKJTMJSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237582; PubChem:CID118586170
|
Local ready
Direct docking supported
|
|
E3L011465
BDB011465
|
BDBM237583
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(OC)ccc3cc(C(=O)NS(C)(=O)=O)ccc23)c2ccccc2OC12CCOCC2
|
C31H36N4O8S 624.716000 |
QCTZLGRXHFZSME-UZTOHYMASA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237583; PubChem:CID73056587
|
Local ready
Direct docking supported
|
|
E3L011466
BDB011466
|
BDBM237584
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(OC)ccc3cc(Br)ccc23)c2ccccc2SC1(C)C
|
C27H30BrN3O3S 556.526000 |
XICQINNJRCACMA-UPCLLVRISA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237584; PubChem:CID90060685
|
Local ready
Direct docking supported
|
|
E3L011467
BDB011467
|
BDBM237585
CN[C@@H](C)C(=O)NC1CSc2ccccc2N(Cc2ccccc2)C1=O
|
C20H23N3O2S 369.490000 |
LHUKROPHQRPJTR-LBAUFKAWSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237585; PubChem:CID73056591
|
Local ready
Direct docking supported
|
|
E3L011468
BDB011468
|
BDBM237586
CN[C@@H](C)C(=O)NC1CS(=O)(=O)c2ccccc2N(Cc2ccccc2)C1=O
|
C20H23N3O4S 401.488000 |
LJSWVVHQVRBWEJ-LBAUFKAWSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237586; PubChem:CID73056593
|
Local ready
Direct docking supported
|
|
E3L011469
BDB011469
|
BDBM237587
CN[C@@H](C)C(=O)NC1CS(=O)(=O)c2ccccc2N(CCCCc2ccccc2)C1=O
|
C23H29N3O4S 443.569000 |
RVYZVHZENJHUGW-KKFHFHRHSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237587; PubChem:CID73056595
|
Local ready
Direct docking supported
|
|
E3L011470
BDB011470
|
BDBM237588
CN[C@@H](C)C(=O)NC1CSc2ccccc2N(Cc2cccc(-c3ccccc3)c2)C1=O
|
C26H27N3O2S 445.588000 |
FPZRNPBAEPRYMG-HXBUSHRASA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237588; PubChem:CID73056899
|
Local ready
Direct docking supported
|
|
E3L011471
BDB011471
|
BDBM237589
CN[C@@H](C)C(=O)N[C@H]1C(=O)N(Cc2c(OC)ccc3cc(Br)ccc23)c2ccc(F)c(F)c2OC12CCOCC2
|
C29H30BrF2N3O5 618.475000 |
QTAWNOXGLQMROR-QMTYFTJSSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237589; PubChem:CID73056901
|
Local ready
Direct docking supported
|
|
E3L011472
BDB011472
|
BDBM237590
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(OC)ccc3cc(Br)ccc23)c2ccc(F)c(F)c2OC12CCOCC2
|
C29H30BrF2N3O5 618.475000 |
QTAWNOXGLQMROR-YHAMSUFESA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237590; PubChem:CID73056903
|
Local ready
Direct docking supported
|
|
E3L011473
BDB011473
|
BDBM237591
CN[C@@H](C)C(=O)N[C@H]1C(=O)N(Cc2c(OC)ccc3cc(Br)ccc23)c2cccc(F)c2OC12CCOCC2
|
C29H31BrFN3O5 600.485000 |
MXULZNXDARNAFL-QLXKLKPCSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237591; PubChem:CID73056905
|
Local ready
Direct docking supported
|
|
E3L011474
BDB011474
|
BDBM237592
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(OC)ccc3cc(Br)ccc23)c2cccc(F)c2OC12CCOCC2
|
C29H31BrFN3O5 600.485000 |
MXULZNXDARNAFL-MRDQGFSESA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237592; PubChem:CID73056907
|
Local ready
Direct docking supported
|
|
E3L011475
BDB011475
|
BDBM237593
CCC(NC)C(=O)N[C@H]1C(=O)N(Cc2c(OC)ccc3cc(Br)ccc23)c2cccc(F)c2OC12CCOCC2
|
C30H33BrFN3O5 614.512000 |
XGAFAULUGFKPHN-JVHFYALYSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237593; PubChem:CID129012532
|
Local ready
Direct docking supported
|
|
E3L011476
BDB011476
|
BDBM237594
CCC(NC)C(=O)N[C@@H]1C(=O)N(Cc2c(OC)ccc3cc(Br)ccc23)c2cccc(F)c2OC12CCOCC2
|
C30H33BrFN3O5 614.512000 |
XGAFAULUGFKPHN-IQHZPMLTSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237594; PubChem:CID129012533
|
Local ready
Direct docking supported
|
|
E3L011477
BDB011477
|
BDBM237595
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(OC)ccc3cc(Br)ccc23)c2ccc(F)cc2OC12CCOCC2
|
C29H31BrFN3O5 600.485000 |
TWMNYKOLSDMFBC-MRDQGFSESA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237595; PubChem:CID73057214
|
Local ready
Direct docking supported
|
|
E3L011478
BDB011478
|
BDBM237596
CCC(NC)C(=O)N[C@@H]1C(=O)N(Cc2c(OC)ccc3cc(Br)ccc23)c2ccc(F)cc2OC12CCOCC2
|
C30H33BrFN3O5 614.512000 |
WONACKBJIGSDAN-IQHZPMLTSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237596; PubChem:CID129012534
|
Local ready
Direct docking supported
|
|
E3L011479
BDB011479
|
BDBM237597
COc1ccc2cc(Br)ccc2c1CN1C(=O)[C@@H](NC(=O)[C@H](C)NCCO)C2(CCOCC2)Oc2ccccc21
|
C30H34BrN3O6 612.521000 |
UFSIJETWBAPLMM-UZTOHYMASA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM237597
|
Local ready
Direct docking supported
|
|
E3L011480
BDB011480
|
BDBM237598
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2cc[n+]([O-])c3ccccc23)c2ccccc2OC12CCOCC2
|
C27H30N4O5 490.560000 |
TUMVVNBILQFZBQ-MHECFPHRSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM237598; PubChem:CID90060595
|
Local ready
Direct docking supported
|