| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L066358
LIG000928
|
EM12-SO2-U
NC1C=CN(S(=O)(=O)c2ccc3c(c2)C(=O)N(C2CCC(=O)NC2=O)C3)C(=O)N1
|
C17H17N5O6S 419.419000 |
MEVKNQWRAYFRMX-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB844
|
Local ready
Direct docking supported
|
|
E3L066359
LIG000929
|
LL-K12-6
CCn1cnc2c(NCc3nc4cc(Cl)c(Cl)cc4[nH]3)nc(N3CCN(S(C)(=O)=O)CC3)nc21
|
C20H23Cl2N9O2S 524.438000 |
MEVXFXVDOZPDAP-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB475
|
Local ready
Direct docking supported
|
|
E3L066360
LIG000930
|
21a
O=C1CCC(N2Cc3cc(C4=C[C@]4(C(=O)OCC(Cl)(Cl)Cl)c4ccc(Br)cc4)ccc3C2=O)C(=O)N1
|
C25H18BrCl3N2O5 612.691000 |
MFIRTWGENGZXDW-WIIYFNMSSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1166
|
Local ready
Direct docking supported
|
|
E3L066361
LIG000931
|
cpmd 2
O=C1CCC(N2Cc3cc(-c4ccccc4)ccc3C2=O)C(=O)N1
|
C19H16N2O3 320.348000 |
MFJRFWHLOUIGAO-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1167
|
Local ready
Direct docking supported
|
|
E3L066363
LIG000933
|
LIG000933
O=C1CCCC(N2C(=O)c3ccccc3C2=O)C(=O)N1
|
C14H12N2O4 272.260000 |
MFXGSTCJBTVJOJ-UHFFFAOYSA-N | Q96SW2 | - |
e3_ligand
e3_ligand:154
|
Local ready
Direct docking supported
|
|
E3L066364
LIG000934
|
QXG-6142
CN1C(=O)CCC(N2Cc3cc(NC(=O)c4cn5ccccc5n4)ccc3C2=O)C1=O
|
C22H19N5O4 417.425000 |
MFXWVQMUTMSWIL-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB535
|
Local ready
Direct docking supported
|
|
E3L066366
LIG000936
|
9
O=C1CCC(N2Cc3c(ccc4c3OCC43CCCN(Cc4ccccc4)CC3)C2=O)C(=O)N1
|
C27H29N3O4 459.546000 |
MGLPMJGCWIFUII-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1460
|
Local ready
Direct docking supported
|
|
E3L066367
LIG000937
|
22o
O=C1CCC(n2nnc3ccc(CNC(=O)Nc4ccc(-c5ccccc5)cc4)cc3c2=O)C(=O)N1
|
C26H22N6O4 482.500000 |
MGYFGGKUTAJMRX-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1009
|
Local ready
Direct docking supported
|
|
E3L066368
LIG000938
|
9d
COc1ccc(-c2ccc3[nH]c(=O)c4nnn(-c5ccc(N6CCN(C(=O)C7=CCCC7)CC6)c(C(F)(F)F)c5)c4c3c2)cn1
|
C32H28F3N7O3 615.616000 |
MHMGPHZLYZBVSC-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB749
|
Local ready
Direct docking supported
|
|
E3L066369
LIG000939
|
MI-389
Cc1[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c(C)c1C(=O)NCCCCCCNc1ccc2c(c1)C(=O)N(C1CCC(=O)NC1=O)C2=O
|
C35H35FN6O6 654.699000 |
MHYXTNHNIYFMTQ-ULJHMMPZSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB236
|
Local ready
Direct docking supported
|
|
E3L066370
LIG000940
|
JQ1-FcN
Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCCCCCCCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CC(=O)NC1=O)c1nnc(C)n1-2
|
C41H47ClN8O5S 799.398000 |
MIVYMDRKVBLXBB-OWHBQTKESA-N | - | - |
MolGlueDB
MolGlueDB:MGDB261
|
Local ready
Direct docking supported
|
|
E3L066371
LIG000941
|
24
NCCSc1nc(NCc2ccc(-n3cccn3)cc2)c2[nH]nc(C3CCC3)c2n1
|
C21H24N8S 420.546000 |
MJACTWDJXKRKAV-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB846
|
Local ready
Direct docking supported
|
|
E3L066372
LIG000942
|
DS23
CC[C@H](CO)Nc1nc(NC)c2ncn(C(C)C)c2n1
|
C13H22N6O 278.360000 |
MJOAYIJIMDIEPY-SECBINFHSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB190
|
Local ready
Direct docking supported
|
|
E3L066373
LIG000943
|
LYG-309
O=C1CCC(N2Cc3cc(CNC(=O)C4COc5ccc(OC(F)(F)F)cc5C4)ccc3C2=O)C(=O)N1
|
C25H22F3N3O6 517.460000 |
MJPLTGIITXCPSU-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1343
|
Local ready
Direct docking supported
|
|
E3L066374
LIG000944
|
Compound 6
Nc1nc2ccccn2c1C(=O)c1ccc2c(c1)CN(C1CCC(=O)NC1=O)C2=O
|
C21H17N5O4 403.398000 |
MJWHDLAUVRDSCO-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB777
|
Local ready
Direct docking supported
|
|
E3L066375
LIG000945
|
54
O=C1CCC(N2Cc3cc(NC(=O)c4ccc5c(c4)OCCO5)ccc3C2=O)C(=O)N1
|
C22H19N3O6 421.409000 |
MLWAXSSCWMTYTR-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1200
|
Local ready
Direct docking supported
|
|
E3L066376
LIG000946
|
LIG000946
NCCCC[C@H](N)C(=O)N[C@H]1CC(=O)NC1=O
|
C10H18N4O3 242.279000 |
MMHKYIJKULUPMV-BQBZGAKWSA-N | Q96SW2 | - |
e3_ligand
e3_ligand:118
|
Local ready
Direct docking supported
|
|
E3L066377
LIG000947
|
cmp16a
NC1CCC(COC(=O)NC2CC(=O)NC2=O)CC1
|
C12H19N3O4 269.301000 |
MMKKSUJIRSZHNE-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB853
|
Local ready
Direct docking supported
|
|
E3L066378
LIG000948
|
LIG000948
O=C1CCC(NC(=O)c2ccccn2)C(=O)N1
|
C11H11N3O3 233.227000 |
MMPCNYVDMALQGW-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, e3_ligand
BindingDB:BDBM50630609; e3_ligand:144
|
Local ready
Direct docking supported
|
|
E3L066379
LIG000949
|
LIG000949
O=C1CCC(N2C(=O)c3cc(F)c4c(c3C2=O)OCO4)C(=O)N1
|
C14H9FN2O6 320.232000 |
MNAPYOSKMLVMFL-UHFFFAOYSA-N | Q96SW2 | - |
e3_ligand
e3_ligand:151
|
Local ready
Direct docking supported
|