| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L066638
LIG001208
|
RR-11055
O=C1CC[C@H](N2Cc3c(ccc4c3OC[C@H]3CNCCN43)C2=O)C(=O)N1
|
C18H20N4O4 356.382000 |
PWSKIUZMQNAFLN-YGRLFVJLSA-N | Q96SW2 | - |
e3_ligand
e3_ligand:135
|
Local ready
Direct docking supported
|
|
E3L066639
LIG001209
|
919278
C[C@H](C(=O)Nc1nc2ccccc2[nH]1)N1Cc2ccccc2C1=O
|
C18H16N4O2 320.352000 |
PWSSISUOJZBZFT-LLVKDONJSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB22
|
Local ready
Direct docking supported
|
|
E3L066640
LIG001210
|
6P
Cn1c(=O)n(C2CCC(=O)NC2=O)c2ccc(C#CCO)cc21
|
C16H15N3O4 313.313000 |
PYEFOHTXCGPPFF-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB542
|
Local ready
Direct docking supported
|
|
E3L066641
LIG001211
|
ZXH-1-1080
O=C1CCC(N2Cc3c(NC(=O)CNc4ccnc(Nc5ccccc5F)n4)cccc3C2=O)C(=O)N1
|
C25H22FN7O4 503.494000 |
PYGHGYXMTJJEGF-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, MolGlueDB
BindingDB:BDBM585774; MolGlueDB:MGDB1136
|
Local ready
Direct docking supported
|
|
E3L066642
LIG001212
|
61
O=C1CCC(N2C(=O)c3ccc(C#Cc4ccccc4)cc3C2=O)C(=O)N1
|
C21H14N2O4 358.353000 |
PZDBMFUJKJPRPT-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB947
|
Local ready
Direct docking supported
|
|
E3L066643
LIG001213
|
dALK-2-neg
COc1ccc(C(=O)CCC(=O)N2CCC(n3cc(-c4cnc(N)c(O[C@H](C)c5c(Cl)ccc(F)c5Cl)c4)cn3)CC2)cc1
|
C32H32Cl2FN5O4 640.543000 |
QACOAZXXGLTZOM-LJQANCHMSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1425
|
Local ready
Direct docking supported
|
|
E3L066644
LIG001214
|
NK7-902
CCN[C@@H]1CC[C@H]2CC[C@@H]1N2c1ccc2c(c1)C(=O)N(C1CCC(=O)NC1=O)C2=O
|
C22H26N4O4 410.474000 |
QAKJEKTXKXAPBP-MGCURZBSSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB460
|
Local ready
Direct docking supported
|
|
E3L066645
LIG001215
|
CPD-2743
O=C1CCC(N2Cc3cccc(OCc4ccc(CN5CCOCC5)cc4)c3C2)C(=O)N1
|
C25H29N3O4 435.524000 |
QANUJVJMFPONSK-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, MolGlueDB
BindingDB:BDBM50631810; MolGlueDB:MGDB317
|
Local ready
Direct docking supported
|
|
E3L066646
LIG001216
|
17b
O=C1CCC(N2Cc3ccc([C@H]4C[C@@]4(COOCC(Cl)(Cl)Cl)c4ccc(Br)cc4)cc3C2=O)C(=O)N1
|
C25H22BrCl3N2O5 616.723000 |
QAPXKPNRTVQPCZ-XARDSYGASA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1237
|
Local ready
Direct docking supported
|
|
E3L066647
LIG001217
|
RG7112
CCOc1cc(C(C)(C)C)ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@@](C)(c2ccc(Cl)cc2)N1C(=O)N1CCN(CCCS(C)(=O)=O)CC1
|
C38H48Cl2N4O4S 727.799000 |
QBGKPEROWUKSBK-QPPIDDCLSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, e3_ligand
BindingDB:BDBM50434287; e3_ligand:11
|
Local ready
Direct docking supported
|
|
E3L066648
LIG001218
|
ML 1-14
CCOC(=O)Oc1cc(NC(=O)C[C@@H]2N=C(c3ccc(Cl)cc3)c3c(sc(C)c3C)-n3c(C)nnc32)c(Cl)cc1Cl
|
C28H24Cl3N5O4S 632.957000 |
QBKZPTQQWUXYEY-NRFANRHFSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB496
|
Local ready
Direct docking supported
|
|
E3L066649
LIG001219
|
ZZ7-16-064
CC(C)S(=O)(=O)c1ccccc1Nc1nc(N[C@@H]2CCCN(C(=O)c3ccc4ccccc4c3)C2)ncc1Cl
|
C29H30ClN5O3S 564.111000 |
QBNZXCXZSWFNKZ-HSZRJFAPSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB172
|
Local ready
Direct docking supported
|
|
E3L066650
LIG001220
|
ML1-13
Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)Nc1ccc(OC(=O)OC(C)(C)C)cc1)c1nnc(C)n1-2
|
C30H30ClN5O4S 592.121000 |
QBQCOKTYWVJGSU-QHCPKHFHSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB254
|
Local ready
Direct docking supported
|
|
E3L066651
LIG001221
|
Lib-B-12L
Cc1nc2ccccn2c1/C=N/NC(=O)COc1ccccc1-c1cccc2c1CN(C1CCC(=O)NC1=O)C2=O
|
C30H26N6O5 550.575000 |
QBYSPODHISPFAH-IBBHUPRXSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB233
|
Local ready
Direct docking supported
|
|
E3L066652
LIG001222
|
6h
O=C1CCC(N2Cc3c(C#CCCCOc4ccccc4)cccc3C2=O)C(=O)N1
|
C24H22N2O4 402.450000 |
QCDVSLZMLAAYRH-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1371
|
Local ready
Direct docking supported
|
|
E3L066653
LIG001223
|
40
CN1CCN(c2ccc3c(c2)C(=O)N(C2CCC(=O)NC2=O)C3=O)CC1
|
C18H20N4O4 356.382000 |
QCWYNTQEGFDVSU-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB578
|
Local ready
Direct docking supported
|
|
E3L066654
LIG001224
|
6a
O=C1CCC(NC(=O)c2ccccc2)C(=O)N1
|
C12H12N2O3 232.239000 |
QDCDITVKCKBZTO-UHFFFAOYSA-N | Q16531, Q96SW2 | Protein cereblon, DNA damage-binding protein 1 |
BindingDB, e3_ligand, MolGlueDB
BindingDB:BDBM631083; e3_ligand:102; MolGlueDB:MGDB900
|
Local ready
Direct docking supported
|
|
E3L066656
LIG001226
|
2M
CC(C)(C)OC(=O)NCCOc1cccc(-c2ccc3c(c2)CN(C2CCC(=O)NC2=O)C3=O)c1
|
C26H29N3O6 479.533000 |
QDENOCVJIAGNTR-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB116
|
Local ready
Direct docking supported
|
|
E3L066657
LIG001227
|
dALK-6
Cc1cc(Nc2ncc(Cl)c(Nc3ccccc3S(=O)(=O)C(C)C)n2)c(OC(C)C)cc1C1CCN(CCCN2CCN(c3cc4c(cc3F)C(=O)N(C3CCC(=O)NC3=O)C4=O)CC2)CC1
|
C48H57ClFN9O7S 958.558000 |
QDGYAUAIIMUPTR-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB283
|
Local ready
Direct docking supported
|
|
E3L066658
LIG001228
|
27d
Cn1c(=O)n(CCC(C)(C)O)c2cc(Nc3nc(N4CCCC(CO)C4)ncc3Cl)ccc21
|
C23H31ClN6O3 474.993000 |
QDLVANQUFIRAGS-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, MolGlueDB
BindingDB:BDBM50511644; MolGlueDB:MGDB551
|
Local ready
Direct docking supported
|