| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L011801
BDB011801
|
BDBM242644
CN[C@@H](C)C(=O)N[C@H]1CN2C(=O)CCCCNC(=O)c3ccc4c(c(OC)ccc4c3)CN(C1=O)c1ccccc12
|
C31H35N5O5 557.651000 |
HJCKKFKEKMJCJL-CYFREDJKSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242644
|
Local ready
Direct docking supported
|
|
E3L011802
BDB011802
|
BDBM242645
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc3[nH]ccc3c2)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C34H33N5O3 559.670000 |
MGSWRKGONRFVIE-ZTOMLWHTSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM242645; PubChem:CID122531550
|
Local ready
Direct docking supported
|
|
E3L011803
BDB011803
|
BDBM242646
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(NC(=O)OCC3c4ccccc4-c4ccccc43)cc2)c2ccccc2N(Cc2c(OC)ccc3cc(C(=O)OC)ccc23)C1=O
|
C49H45N5O8 831.926000 |
GSYFZEKZPQSPGM-GJPBYDNQSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242646
|
Local ready
Direct docking supported
|
|
E3L011804
BDB011804
|
BDBM242647
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2cccc3[nH]ccc23)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C34H33N5O3 559.670000 |
IFHOHRZNKPMEPE-ZTOMLWHTSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM242647; PubChem:CID122531464
|
Local ready
Direct docking supported
|
|
E3L011805
BDB011805
|
BDBM242648
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(N)cc2)c2ccccc2N(Cc2c(OC)ccc3cc(C(=O)OC)ccc23)C1=O
|
C34H35N5O6 609.683000 |
LIVBSIKTRVIQMV-DCFHFQCYSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242648
|
Local ready
Direct docking supported
|
|
E3L011806
BDB011806
|
BDBM242649
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2cccc3[nH]ncc23)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C33H32N6O3 560.658000 |
SCHUKIUZPJPNGL-KMRXNPHXSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM242649; PubChem:CID122531382
|
Local ready
Direct docking supported
|
|
E3L011807
BDB011807
|
BDBM242650
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(N)cc2)c2ccccc2N(Cc2c(OC)ccc3cc(C(=O)O)ccc23)C1=O
|
C33H33N5O6 595.656000 |
YVMFJSWIPWZQQR-SIBVEZHUSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242650
|
Local ready
Direct docking supported
|
|
E3L011808
BDB011808
|
BDBM242651
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccccc2[C@H](C)O)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C34H36N4O4 564.686000 |
TVHGDHABYXJTBR-BOSRLCDASA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242651
|
Local ready
Direct docking supported
|
|
E3L011809
BDB011809
|
BDBM242652
CN[C@@H](C)C(=O)N[C@H]1CN2CCCNC(=O)c3ccc4c(c(OC)ccc4c3)CN(C1=O)c1ccccc12
|
C29H33N5O4 515.614000 |
ILJSXABYHBJFSO-MBSDFSHPSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242652
|
Local ready
Direct docking supported
|
|
E3L011810
BDB011810
|
BDBM242653
CCN[C@@H](C)C(=O)N[C@H]1CN(C(=O)CS(C)(=O)=O)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C29H33BrN4O6S 645.576000 |
PXMMLWALQXHVIQ-MBSDFSHPSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242653
|
Local ready
Direct docking supported
|
|
E3L011811
BDB011811
|
BDBM242654
CN[C@@H](C)C(=O)N[C@H]1CN2CCNC(=O)c3ccc4c(c(OC)ccc4c3)CN(C1=O)c1ccccc12
|
C28H31N5O4 501.587000 |
UXMSPXIBLYEUGT-JTSKRJEESA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242654
|
Local ready
Direct docking supported
|
|
E3L011812
BDB011812
|
BDBM242655
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(F)cc2)c2cc(C#N)ccc2N(Cc2c(OC)ccc3c(Br)cccc23)C1=O
|
C33H29BrFN5O4 658.528000 |
SRPYIGHROMQIEO-PPHZAIPVSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242655
|
Local ready
Direct docking supported
|
|
E3L011813
BDB011813
|
BDBM242656
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)CCCCC(=O)O)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C31H36N4O5 544.652000 |
SLPPHWLGGWMBHJ-OFVILXPXSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242656
|
Local ready
Direct docking supported
|
|
E3L011814
BDB011814
|
BDBM242657
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(F)cc2)c2cc(C#N)ccc2N(Cc2c(OC(F)F)ccc3ccccc23)C1=O
|
C33H28F3N5O4 615.612000 |
LKJDLVPHMUIGSF-SIBVEZHUSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242657
|
Local ready
Direct docking supported
|
|
E3L011815
BDB011815
|
BDBM242658
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)CCN)c2ccccc2N(Cc2c(OC)ccc3cc(C(=O)OC)ccc23)C1=O
|
C30H35N5O6 561.639000 |
OMXCQEFOIWXWJB-MBSDFSHPSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242658
|
Local ready
Direct docking supported
|
|
E3L011816
BDB011816
|
BDBM242659
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc3cc[nH]c3c2)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C34H33N5O3 559.670000 |
NNKUQMKKKFKIOF-ZTOMLWHTSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM242659; PubChem:CID122531471
|
Local ready
Direct docking supported
|
|
E3L011817
BDB011817
|
BDBM242660
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)CCN)c2ccccc2N(Cc2c(OC)ccc3cc(C(=O)O)ccc23)C1=O
|
C29H33N5O6 547.612000 |
YUQXREDHCHFNGW-JTSKRJEESA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242660
|
Local ready
Direct docking supported
|
|
E3L011818
BDB011818
|
BDBM242662
CN[C@@H](C)C(=O)N[C@H]1CN2C(=O)CCNC(=O)c3ccc4c(c(OC)ccc4c3)CN(C1=O)c1ccccc12
|
C29H31N5O5 529.597000 |
RRJQCQZSAWTOKG-JTSKRJEESA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242662
|
Local ready
Direct docking supported
|
|
E3L011819
BDB011819
|
BDBM242663
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(F)cc2)c2cc(C#N)ccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C33H29BrFN5O4 658.528000 |
LSHPLXHILQVMFS-PPHZAIPVSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM242663
|
Local ready
Direct docking supported
|
|
E3L011820
BDB011820
|
BDBM242664
CC(=O)c1ccc(C(=O)N2C[C@H](NC(=O)[C@H](C)N)C(=O)N(Cc3c(C)ccc4ccccc34)c3ccccc32)cc1
|
C33H32N4O4 548.643000 |
HDRZXKUDFVCNST-KMRXNPHXSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM242664; PubChem:CID118077246
|
Local ready
Direct docking supported
|