| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L066016
LIG000586
|
DS11
CC[C@H](CO)Nc1nc(NCCCc2ccccc2)c2ncn(C(C)C)c2n1
|
C21H30N6O 382.512000 |
HXKIFNLNVMCGAG-QGZVFWFLSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB228
|
Local ready
Direct docking supported
|
|
E3L066017
LIG000587
|
39
OCCC1CCCCN1c1cc(NCc2ccc(-c3ccco3)cc2)n2ncc(Br)c2n1
|
C24H26BrN5O2 496.409000 |
HXUHXGDDLUHZPJ-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB315
|
Local ready
Direct docking supported
|
|
E3L066018
LIG000588
|
79
O=C1CCC(N2C(=O)c3ccc(NC(=O)c4cccnc4)cc3C2=O)C(=O)N1
|
C19H14N4O5 378.344000 |
HYBOIGVMNUVVSH-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB958
|
Local ready
Direct docking supported
|
|
E3L066019
LIG000589
|
LIG000589
CC(C)(C)OC(=O)Cn1ccc(=O)n(-c2ccc(F)cc2)c1=O
|
C16H17FN2O4 320.320000 |
HYWDNVLVMFMPLM-UHFFFAOYSA-N | Q96SW2 | - |
e3_ligand
e3_ligand:160
|
Local ready
Direct docking supported
|
|
E3L066020
LIG000590
|
13
Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C2CCC(=O)NC2=O)C3=O)cc1
|
C20H17N3O6S 427.438000 |
HYYJFYAZYUNSAB-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB364
|
Local ready
Direct docking supported
|
|
E3L066021
LIG000591
|
ZXH-2-156
O=C1CCC(N2Cc3c(NC4=NC(c5ccc(F)cc5)Nc5[nH]cnc54)cccc3C2=O)C(=O)N1
|
C24H20FN7O3 473.468000 |
HZANPENDDSLSTD-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1149
|
Local ready
Direct docking supported
|
|
E3L066022
LIG000592
|
LIG000592
O=C1CCC(N2C(=O)c3cccc4cccc2c34)C(=O)N1
|
C16H12N2O3 280.283000 |
HZVJJENRQLZSSB-UHFFFAOYSA-N | Q96SW2 | - |
e3_ligand
e3_ligand:132
|
Local ready
Direct docking supported
|
|
E3L066023
LIG000593
|
5
O=C1CCC(N2Cc3c(ccc4c3OCC43CCN(Cc4ccccc4)CC3)C2=O)C(=O)N1
|
C26H27N3O4 445.519000 |
HZXUBAMXBADXJI-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1456
|
Local ready
Direct docking supported
|
|
E3L066024
LIG000594
|
EM12-SO2F
O=C1CCC(N2Cc3ccc(S(=O)(=O)F)cc3C2=O)C(=O)N1
|
C13H11FN2O5S 326.305000 |
IAJNULNMWPZFDR-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, MolGlueDB
BindingDB:BDBM50630767; MolGlueDB:MGDB1245
|
Local ready
Direct docking supported
|
|
E3L066025
LIG000595
|
DS30
CC[C@H](CO)Nc1nc(NCCCc2cccc(C)c2)c2ncn(C(C)C)c2n1
|
C22H32N6O 396.539000 |
IAQVCGQJJMTIMM-GOSISDBHSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1581
|
Local ready
Direct docking supported
|
|
E3L066026
LIG000596
|
LIG000596
O=C(CCl)NC(C(=O)NCc1ccccc1)c1ccc(Cl)c(Cl)c1
|
C17H15Cl3N2O2 385.678000 |
IARWWDNCNPMRCK-UHFFFAOYSA-N | Q8TEB1 | - |
e3_ligand
e3_ligand:67
|
Local ready
Direct docking supported
|
|
E3L066027
LIG000597
|
NRX-1933
O=C(Nc1cccc(-c2nnn[nH]2)c1)c1ccc(C(F)(F)F)[nH]c1=O
|
C14H9F3N6O2 350.260000 |
IAVMZDPIQIVLOG-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB880
|
Local ready
Direct docking supported
|
|
E3L066028
LIG000598
|
compound 6
COC(=O)c1ccccc1-c1cn(C2CCC(=O)NC2=O)nn1
|
C15H14N4O4 314.301000 |
IBMBUDCWYLROSU-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB606
|
Local ready
Direct docking supported
|
|
E3L066029
LIG000599
|
(3R,7S)-JA-L-Ile
CC/C=C\C[C@@H]1C(=O)CC[C@@H]1CC(=O)N[C@H](C(=O)O)[C@@H](C)CC
|
C18H29NO4 323.433000 |
IBZYPBGPOGJMBF-QPERPISQSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB2
|
Local ready
Direct docking supported
|
|
E3L066030
LIG000600
|
LIG000600
O=C1CCC(N2C(=O)c3ccccc3C2=O)C(=O)O1
|
C13H9NO5 259.217000 |
ICDLEMPZXFCQEB-UHFFFAOYSA-N | Q96SW2 | - |
e3_ligand
e3_ligand:143
|
Local ready
Direct docking supported
|
|
E3L066031
LIG000601
|
14n
O=C1CCC(CSc2ccccn2)C(=O)N1
|
C11H12N2O2S 236.296000 |
IDDMGIZANZXQLO-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, MolGlueDB
BindingDB:BDBM50625132; MolGlueDB:MGDB942
|
Local ready
Direct docking supported
|
|
E3L066032
LIG000602
|
28
Cc1ccc(N2CCN(Cc3ccc4c(c3)CN(C3CCC(=O)NC3=O)C4=O)C2=O)cc1Cl
|
C24H23ClN4O4 466.925000 |
IDKCOYRQNGTXHA-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB287
|
Local ready
Direct docking supported
|
|
E3L066033
LIG000603
|
R13
O=C1CCC(NC(=O)c2cccc3[nH]ccc23)C(=O)N1
|
C14H13N3O3 271.276000 |
IDRTZQLGXDUGJS-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1393
|
Local ready
Direct docking supported
|
|
E3L066034
LIG000604
|
10
CC[C@H](CO)Nc1nc(NCc2ccc(-c3ccc(C(=O)NC45C[C@H]6C[C@H](C4)C[C@@H](C5)C6)cn3)cc2)c2ncn(C(C)C)c2n1
|
C35H44N8O2 608.791000 |
IEKSNRZAVYTWFY-LYNJVBHRSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB200
|
Local ready
Direct docking supported
|
|
E3L066035
LIG000605
|
NCT02
Cc1cnc(NC(=O)Cc2coc3cc4c(cc23)CCC4)s1
|
C17H16N2O2S 312.394000 |
IELCYEUTXLYDOV-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB391
|
Local ready
Direct docking supported
|