| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L066927
LIG001497
|
LIG001497
CNC(=O)C[C@H](NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H](NC(C)=O)C(C)C)c1ccccc1
|
C22H32N4O5 432.521000 |
UEIQRCHIEZGBTN-LXZJYRNTSA-N | P40337 | - |
e3_ligand
e3_ligand:36
|
Local ready
Direct docking supported
|
|
E3L066928
LIG001498
|
(R)-Thalidomide
O=C1CC[C@@H](N2C(=O)c3ccccc3C2=O)C(=O)N1
|
C13H10N2O4 258.233000 |
UEJJHQNACJXSKW-SECBINFHSA-N | Q96SW2 | Protein cereblon |
BindingDB, MolGlueDB
BindingDB:BDBM65362; MolGlueDB:MGDB1318
|
Local ready
Direct docking supported
|
|
E3L066929
LIG001499
|
Thalidomide
O=C1CCC(N2C(=O)c3ccccc3C2=O)C(=O)N1
|
C13H10N2O4 258.233000 |
UEJJHQNACJXSKW-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1, Protein cereblon |
BindingDB, e3_ligand, MolGlueDB
BindingDB:BDBM50070114; e3_ligand:3; MolGlueDB:MGDB1041
|
Local ready
Direct docking supported
|
|
E3L066943
LIG001513
|
(S)-Thalidomide
O=C1CC[C@H](N2C(=O)c3ccccc3C2=O)C(=O)N1
|
C13H10N2O4 258.233000 |
UEJJHQNACJXSKW-VIFPVBQESA-N | Q96SW2 | Protein cereblon |
BindingDB, MolGlueDB
BindingDB:BDBM65457; MolGlueDB:MGDB1317
|
Local ready
Direct docking supported
|
|
E3L066945
LIG001515
|
14t
CC(=O)Nc1ccccc1SCC1CCC(=O)NC1=O
|
C14H16N2O3S 292.360000 |
UELXYEXGBZIFJJ-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, MolGlueDB
BindingDB:BDBM50625138; MolGlueDB:MGDB74
|
Local ready
Direct docking supported
|
|
E3L066946
LIG001516
|
NE-002
O=C1CCC(N2C(=O)c3c(F)ccc(F)c3C2=O)C(=O)N1
|
C13H8F2N2O4 294.213000 |
UFGXUQNEFLIIMO-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, MolGlueDB
BindingDB:BDBM777354; MolGlueDB:MGDB988
|
Local ready
Direct docking supported
|
|
E3L066947
LIG001517
|
LCL161
CN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1c1nc(C(=O)c2ccc(F)cc2)cs1)C1CCCCC1
|
C26H33FN4O3S 500.640000 |
UFPFGVNKHCLJJO-SSKFGXFMSA-N | P98170, Q13489, Q13490, Q96CA5 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 7, E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, e3_ligand
BindingDB:BDBM50441356; e3_ligand:91
|
Local ready
Direct docking supported
|
|
E3L066948
LIG001518
|
Compound 9
O=C1CCC(N2Cc3cc(-c4nc5ccccn5c4Nc4ccccc4)ccc3C2=O)C(=O)N1
|
C26H21N5O3 451.486000 |
UFQUXXZXMOACKI-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1163
|
Local ready
Direct docking supported
|
|
E3L066949
LIG001519
|
LYG-410
O=C1CCC(N2Cc3cc(CNC(=O)C4=Cc5cccc(OC(F)(F)F)c5OC4)ccc3C2=O)C(=O)N1
|
C25H20F3N3O6 515.444000 |
UGPBFKNALBKCHI-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1353
|
Local ready
Direct docking supported
|
|
E3L066950
LIG001520
|
14a
O=C1CCC(CSc2ccccc2)C(=O)N1
|
C12H13NO2S 235.308000 |
UGQNTSHUUBOKQL-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, MolGlueDB
BindingDB:BDBM50625119; MolGlueDB:MGDB939
|
Local ready
Direct docking supported
|
|
E3L066951
LIG001521
|
dALK-3-neg
COc1ccc(C(=O)CCC(=O)N2CCN(C3CCN(c4ccc(Nc5ncc(Cl)c(Nc6ccccc6P(C)(C)=O)n5)c(OC)c4)CC3)CC2)cc1
|
C39H47ClN7O5P 760.276000 |
UGWNOEZJDMIWOA-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1431
|
Local ready
Direct docking supported
|
|
E3L066952
LIG001522
|
DS36
CCCCN(CCCC)CCCCCNc1nc(N[C@H](CC)CO)nc2c1ncn2C(C)C
|
C25H47N7O 461.699000 |
UHODWWXIRXXGAN-OAQYLSRUSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1587
|
Local ready
Direct docking supported
|
|
E3L066953
LIG001523
|
9e
O=C1CCC(N2Cc3c(cccc3-c3cccc(O)c3)C2=O)C(=O)N1
|
C19H16N2O4 336.347000 |
UHXWHQHVKYWIFX-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1379
|
Local ready
Direct docking supported
|
|
E3L066954
LIG001524
|
57
O=C1CCC(N2Cc3cc(NC(=O)C4=Cc5ccccc5OC4)ccc3C2=O)C(=O)N1
|
C23H19N3O5 417.421000 |
UIFPBNRHYJGQSS-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1210
|
Local ready
Direct docking supported
|
|
E3L066955
LIG001525
|
BTX306
Cc1ccc(NC(=O)NCc2scc3c2CN(C2CCC(=O)NC2=O)C3=O)cc1Cl
|
C20H19ClN4O4S 446.916000 |
UIJJBTOFEJMPCM-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1288
|
Local ready
Direct docking supported
|
|
E3L066956
LIG001526
|
5
COc1cc(N)c2c(c1)C(=O)N(C1CCC(=O)NC1=O)C2=O
|
C14H13N3O5 303.274000 |
UJHUIUOWOMMKOH-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1283
|
Local ready
Direct docking supported
|
|
E3L066957
LIG001527
|
compound 8
Nc1ncccc1-c1cn(C2CCC(=O)NC2=O)nn1
|
C12H12N6O2 272.268000 |
UJISXXKHIJMUGT-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB832
|
Local ready
Direct docking supported
|
|
E3L066958
LIG001528
|
SJF-620
Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)nn2C1CCN(CCOCCOCCOc2ccc3c(c2)CN(C2CCC(=O)NC2=O)C3=O)CC1
|
C41H44N8O7 760.852000 |
UJJYPBWMGIPXOE-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB783
|
Local ready
Direct docking supported
|
|
E3L066959
LIG001529
|
14o
O=C1CCC(CSc2ncccn2)C(=O)N1
|
C10H11N3O2S 237.284000 |
UJLABZCQLAKSNX-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, MolGlueDB
BindingDB:BDBM50625133; MolGlueDB:MGDB943
|
Local ready
Direct docking supported
|
|
E3L066960
LIG001530
|
MMH249
Cc1sc2c(c1C)C(c1ccc(NC(=O)CCl)cc1)=N[C@@H](CC(=O)OC(C)(C)C)c1nnc(C)n1-2
|
C25H28ClN5O3S 514.051000 |
UJMDKYUESHTQNZ-SFHVURJKSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB271
|
Local ready
Direct docking supported
|