| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L011721
BDB011721
|
BDBM241189
CN[C@@H](C)C(=O)N[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C31H31N5O6S 601.685000 |
UKJCAVJNBGIXQF-IDISGSTGSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM241189; PubChem:CID118076823
|
Local ready
Direct docking supported
|
|
E3L011722
BDB011722
|
BDBM241191
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)COCCOC)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C30H36N4O5 532.641000 |
ZSDHXPRMBBKSNO-OFVILXPXSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM241191
|
Local ready
Direct docking supported
|
|
E3L011723
BDB011723
|
BDBM241212
CN[C@@H](C)C(=O)N[C@H]1CN(S(=O)(=O)c2ccccc2)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C31H32N4O4S 556.688000 |
OFVYHQRRFQEYLE-CUNXSJBXSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM241212; PubChem:CID118076892
|
Local ready
Direct docking supported
|
|
E3L011724
BDB011724
|
BDBM241258
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)CC(N)=O)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C28H31N5O4 501.587000 |
BUQBEWDAVVZXLE-AVRDEDQJSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM241258
|
Local ready
Direct docking supported
|
|
E3L011725
BDB011725
|
BDBM241366
CN[C@@H](C)C(=O)N[C@H]1CN(S(=O)(=O)c2ccc(OC)cc2)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C32H34N4O5S 586.714000 |
BRVFBTWDEKUMFH-DWACAAAGSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM241366; PubChem:CID118076717
|
Local ready
Direct docking supported
|
|
E3L011726
BDB011726
|
BDBM241602
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)CN2CCN(C)CC2)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C32H40N6O3 556.711000 |
GEPDCKPUAWJVJS-HOFKKMOUSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM241602
|
Local ready
Direct docking supported
|
|
E3L011727
BDB011727
|
BDBM241607
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
|
C34H35BrN4O5 659.581000 |
LNZZPMFSHPPZAH-ZWCJHOFGSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM241607
|
Local ready
Direct docking supported
|
|
E3L011728
BDB011728
|
BDBM241615
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)COCCOCCOC)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C32H40N4O6 576.694000 |
VHGLIEZYKBMCEQ-HOFKKMOUSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM241615
|
Local ready
Direct docking supported
|
|
E3L011729
BDB011729
|
BDBM241648
CN[C@@H](C)C(=O)N[C@H]1CN(C(C)=O)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C27H30N4O3 458.562000 |
XGHINJSUQKBCFU-MBSDFSHPSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM241648; PubChem:CID118086412
|
Local ready
Direct docking supported
|
|
E3L011730
BDB011730
|
BDBM241649
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(C(C)=O)cc2)c2ccccc2N(CC(=O)Nc2cccc3ccccc23)C1=O
|
C34H33N5O5 591.668000 |
LVLHNAAVZVZZSV-KMRXNPHXSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM241649
|
Local ready
Direct docking supported
|
|
E3L011731
BDB011731
|
BDBM241657
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)CCCC(=O)O)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C30H34N4O5 530.625000 |
COJWRLRWHVCSIG-RDPSFJRHSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM241657
|
Local ready
Direct docking supported
|
|
E3L011732
BDB011732
|
BDBM241658
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(C(C)=O)cc2)c2ccccc2N(CC(=O)Nc2nccs2)C1=O
|
C27H28N6O5S 548.625000 |
VOWGDTLUUUNJEC-JXFKEZNVSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM241658
|
Local ready
Direct docking supported
|
|
E3L011733
BDB011733
|
BDBM241671
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)CCC(=O)O)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C29H32N4O5 516.598000 |
LFQRRIJJVBFKIS-CVDCTZTESA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM241671
|
Local ready
Direct docking supported
|
|
E3L011734
BDB011734
|
BDBM241672
CN[C@@H](C)C(=O)N(C)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C33H32BrN5O6 674.552000 |
KKYBDKUVDMXIKG-WRONEBCDSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM241672
|
Local ready
Direct docking supported
|
|
E3L011735
BDB011735
|
BDBM241682
CNC(=O)N1C[C@H](NC(=O)[C@H](C)NC)C(=O)N(Cc2c(C)ccc3ccccc23)c2ccccc21
|
C27H31N5O3 473.577000 |
ZWOABPMSDSIAAD-AVRDEDQJSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM241682
|
Local ready
Direct docking supported
|
|
E3L011736
BDB011736
|
BDBM241683
CN[C@@H](C)C(=O)N[C@H]1CN2C(=O)CNC(=O)c3ccc4c(c(OC)ccc4c3)CN(C1=O)c1ccccc12
|
C28H29N5O5 515.570000 |
FEKGYZNXNRHBPQ-KKSFZXQISA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM241683
|
Local ready
Direct docking supported
|
|
E3L011737
BDB011737
|
BDBM241690
CN[C@@H](C)C(=O)N[C@H]1CN(S(=O)(=O)CS(C)(=O)=O)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C27H32N4O6S2 572.709000 |
RAUKLMVKCSKQSO-CVDCTZTESA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM241690
|
Local ready
Direct docking supported
|
|
E3L011738
BDB011738
|
BDBM241698
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(C(C)=O)cc2)c2ccccc2N(CC(=O)Nc2nc3ccccc3s2)C1=O
|
C31H30N6O5S 598.685000 |
PJTRUGDAMFFNAG-MBSDFSHPSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM241698
|
Local ready
Direct docking supported
|
|
E3L011739
BDB011739
|
BDBM241699
CN[C@@H](C)C(=O)N[C@H]1CN(S(C)(=O)=O)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C26H30N4O4S 494.617000 |
JASWQEPLVCSAEY-AVRDEDQJSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM241699; PubChem:CID118077107
|
Local ready
Direct docking supported
|
|
E3L011740
BDB011740
|
BDBM241700
CN[C@@H](C)C(=O)NC1C(=O)N(Cc2c(OC)ccc3ccccc23)c2ccccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O
|
C36H42N4O4 594.756000 |
ROIZRCWZUQNFED-WQJYIYLMSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM241700; PubChem:CID122531373
|
Local ready
Direct docking supported
|