| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L067346
LIG001916
|
7
O=C1CCN(c2ccc(N3CCNCC3)cc2)C(=O)N1
|
C14H18N4O2 274.324000 |
YWVCKRDCEOWGQH-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1319
|
Local ready
Direct docking supported
|
|
E3L067347
LIG001917
|
9g
Cc1ccc(NC(=O)/C=C/c2ccc3c(c2)C(=O)N(C2CCC(=O)NC2=O)C3)cc1Cl
|
C23H20ClN3O4 437.883000 |
YWVOORFJARFYGT-XBXARRHUSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB332
|
Local ready
Direct docking supported
|
|
E3L067348
LIG001918
|
(R,S)-3c
CC(C)(C)NC(=O)[C@@]1(C)CCCC(=O)N1[C@H]1CCC(=O)NC1=O
|
C16H25N3O4 323.393000 |
YXRLGZBVUSYIFA-MGPLVRAMSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB93
|
Local ready
Direct docking supported
|
|
E3L067349
LIG001919
|
(S,S)-3c
CC(C)(C)NC(=O)[C@]1(C)CCCC(=O)N1[C@H]1CCC(=O)NC1=O
|
C16H25N3O4 323.393000 |
YXRLGZBVUSYIFA-QFYYESIMSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB96
|
Local ready
Direct docking supported
|
|
E3L067350
LIG001920
|
23
O=C1CCC(N2Cc3cc(CNC(=O)Nc4ccc(Cl)c(Cl)c4)ccc3C2=O)C(=O)N1
|
C21H18Cl2N4O4 461.305000 |
YXTVLLJONNNBNQ-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1185
|
Local ready
Direct docking supported
|
|
E3L067351
LIG001921
|
SJPYT-195
COc1ccc(OC)c(-n2nnc(C(=O)Nc3cc(Oc4cccc5c4C(=O)N(C4CCC(=O)NC4=O)C5=O)cc(C(C)(C)C)c3)c2C)c1
|
C35H34N6O8 666.691000 |
YYDMLWLLMFAABT-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB693
|
Local ready
Direct docking supported
|
|
E3L067353
LIG001923
|
9
Cc1ccc(NS(=O)(=O)c2ccc(CN)cc2)c2[nH]cc(C#N)c12
|
C17H16N4O2S 340.408000 |
YYJILEGPDDMZAV-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1406
|
Local ready
Direct docking supported
|
|
E3L067354
LIG001924
|
14
O=C1CCC(N2Cc3c(ccc4c3OCC43CCN(Cc4ccccn4)CC3)C2=O)C(=O)N1
|
C25H26N4O4 446.507000 |
YZHAQINEPFJCRZ-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1465
|
Local ready
Direct docking supported
|
|
E3L067355
LIG001925
|
SJPYT-219
COc1ccc(OC)c(-n2nnc(C(=O)Nc3cc(NC(=O)CNc4cccc5c4C(=O)N(C4CCC(=O)NC4=O)C5=O)cc(C(C)(C)C)c3)c2C)c1
|
C37H38N8O8 722.759000 |
YZHXWHSTPGNHKE-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB687
|
Local ready
Direct docking supported
|
|
E3L067356
LIG001926
|
4
CC(C)(C)[C@H](NC(=O)c1cnn2c1OCCC2)C(=O)N1C[C@H](O)C[C@H]1C(=O)NCc1ccc(-c2ccc(Cl)cc2)cc1
|
C31H36ClN5O5 594.112000 |
YZUJCTBWTOYXLI-DMTNHVFBSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1449
|
Local ready
Direct docking supported
|
|
E3L067357
LIG001927
|
7a
COc1cc2onc(C)c2cc1NS(=O)(=O)c1cc(Br)ccc1OCC(=O)NCCNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
|
C32H29BrN6O10S 769.587000 |
YZXOOGQDTNMNMH-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB735
|
Local ready
Direct docking supported
|
|
E3L067358
LIG001928
|
14d
O=C1CCC(CSc2ccc(F)cc2)C(=O)N1
|
C12H12FNO2S 253.298000 |
ZAWXLZWSDZNXTL-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, MolGlueDB
BindingDB:BDBM50625122; MolGlueDB:MGDB937
|
Local ready
Direct docking supported
|
|
E3L067359
LIG001929
|
QXG-133-6
O=C1CCC(N2Cc3cc(NC(=O)C4=NC5C=CC=CC5=N4)ccc3C2=O)C(=O)N1
|
C21H17N5O4 403.398000 |
ZBHGPYOZHLKXGR-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1071
|
Local ready
Direct docking supported
|
|
E3L067360
LIG001930
|
R7
O=C1CCC(NC(=O)c2c[nH]c3ccccc23)C(=O)N1
|
C14H13N3O3 271.276000 |
ZCTRHIPLIVOKIE-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, MolGlueDB
BindingDB:BDBM631080; MolGlueDB:MGDB1387
Related BindingDB:BDBM631090; Related BindingDB:BDBM631091
|
Local ready
Direct docking supported
|
|
E3L067361
LIG001931
|
KI-696
COc1cc([C@@H](CC(=O)O)c2ccc(C)c(CN3C[C@@H](C)Oc4ccccc4S3(=O)=O)c2)cc2nnn(C)c12
|
C28H30N4O6S 550.637000 |
ZDNGJXBUEQNFBQ-GCJKJVERSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, e3_ligand
BindingDB:BDBM50180850; e3_ligand:98
Related BindingDB:BDBM304748; Related BindingDB:BDBM304728; Related BindingDB:BDBM304721; Related BindingDB:BDBM304727
|
Local ready
Direct docking supported
|
|
E3L067362
LIG001932
|
26
CN1CCN(c2cccc3c2C(=O)N(C2CCC(=O)NC2=O)C3=O)CC1
|
C18H20N4O4 356.382000 |
ZDTKBCLZFCRYPN-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB577
|
Local ready
Direct docking supported
|
|
E3L067363
LIG001933
|
28
CC(C)Nc1n[nH]c2c(CN3CCCC3)cc(-c3ccc4c(c3)CN(C3CCC(=O)NC3=O)C4=O)nc12
|
C27H31N7O3 501.591000 |
ZEGBRJSQYXZREI-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, MolGlueDB
BindingDB:BDBM755936; MolGlueDB:MGDB1519
|
Local ready
Direct docking supported
|
|
E3L067364
LIG001934
|
DS67
CCc1cccc(CCCNc2nc(N[C@H](CC)CO)nc3c2ncn3C(C)C)c1
|
C23H34N6O 410.566000 |
ZELMGONKTIAQJA-LJQANCHMSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1580
|
Local ready
Direct docking supported
|
|
E3L067365
LIG001935
|
DS10
CC[C@H](CO)Nc1nc(NCCCCCCc2ccccc2)c2ncn(C(C)C)c2n1
|
C24H36N6O 424.593000 |
ZEVUXZKCCBIGIP-HXUWFJFHSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1568
|
Local ready
Direct docking supported
|
|
E3L067366
LIG001936
|
DEG-77
COc1cccc2c1OCC(C(=O)Nc1ccc3c(c1)CN(C1CCC(=O)NC1=O)C3=O)=C2
|
C24H21N3O6 447.447000 |
ZFAKJMUJUNDGEI-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB718
|
Local ready
Direct docking supported
|