| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L065883
LIG000453
|
MMH1-NR
CCC(=O)Nc1ccc(C2=N[C@@H](CC(=O)OC(C)(C)C)c3nnc(C)n3-c3sc(C)c(C)c32)cc1
|
C26H31N5O3S 493.633000 |
GNAFUNRWKRPKPL-IBGZPJMESA-N | - | - |
MolGlueDB
MolGlueDB:MGDB428
|
Local ready
Direct docking supported
|
|
E3L065884
LIG000454
|
IBG4
Cc1sc2c(c1C)C(c1ccc(-c3ccc(F)c(NC(=O)c4cnn5cccnc45)c3)cc1)=N[C@@H](CC(=O)N(C)C)c1nnc(C)n1-2
|
C34H30FN9O2S 647.740000 |
GNAZHLWOOVUAFO-MHZLTWQESA-N | - | - |
MolGlueDB
MolGlueDB:MGDB245
|
Local ready
Direct docking supported
|
|
E3L065885
LIG000455
|
6
CC(C)(c1ccc(OCC2CCN(C(=O)CCCCCNc3cccc4c3C(=O)N(C3CCC(=O)NC3=O)C4=O)CC2)cc1)c1ccc(OC[C@H](O)CCl)cc1
|
C43H51ClN4O8 787.354000 |
GOBZAHUSOHEKHP-RACIXVTASA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1537
|
Local ready
Direct docking supported
|
|
E3L065886
LIG000456
|
MMH271
Cc1sc2c(c1C)C(c1ccc(/C=C/C(N)=O)cc1)=N[C@@H](CC(=O)OC(C)(C)C)c1nnc(C)n1-2
|
C26H29N5O3S 491.617000 |
GOJBPUJXRNKDPC-DLENHJPASA-N | - | - |
MolGlueDB
MolGlueDB:MGDB265
|
Local ready
Direct docking supported
|
|
E3L065887
LIG000457
|
25
CC[C@H](CO)Nc1nc(NCc2ccc(N3CCOCC3)cc2)c2ncn(C(C)C)c2n1
|
C23H33N7O2 439.564000 |
GOMSBCKJOIRMNC-GOSISDBHSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB223
|
Local ready
Direct docking supported
|
|
E3L065888
LIG000458
|
Lenalidomide
Nc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O
|
C13H13N3O3 259.265000 |
GOTYRUGSSMKFNF-UHFFFAOYSA-N | Q16531, Q96SW2 | Protein cereblon, DNA damage-binding protein 1 |
BindingDB, e3_ligand, MolGlueDB
BindingDB:BDBM65454; e3_ligand:4; e3_ligand:64; MolGlueDB:MGDB828
|
Local ready
Direct docking supported
|
|
E3L065913
LIG000483
|
cmp12a
O=C(O)CCC(=O)NCc1ccc(COC(=O)NC2CC(=O)NC2=O)cc1
|
C17H19N3O7 377.353000 |
GOZKVJYDZYJVDH-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB887
|
Local ready
Direct docking supported
|
|
E3L065914
LIG000484
|
HQ008
Cc1cnc(NC(=O)Cc2csc(Nc3cccc(-n4cccn4)n3)n2)s1
|
C17H15N7OS2 397.489000 |
GOZYMSUKKKEICN-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB400
|
Local ready
Direct docking supported
|
|
E3L065915
LIG000485
|
cmp7h
O=C1CC(NC(=O)c2sc3cccc(Cl)c3c2Cl)C(=O)N1
|
C13H8Cl2N2O3S 343.191000 |
GQJDFUNHZMFVSN-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB907
|
Local ready
Direct docking supported
|
|
E3L065916
LIG000486
|
MDM2-IN-1
O=C(O)[C@@H]1NC2(CCCCC2)[C@@]2(C(=O)Nc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
|
C23H21Cl2FN2O3 463.336000 |
GQQZEPFAYBPYQU-GEQKSPFYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, e3_ligand
BindingDB:BDBM112756; e3_ligand:129
|
Local ready
Direct docking supported
|
|
E3L065917
LIG000487
|
58
Cc1noc(C)c1-c1ccc2c(c1)C(=O)N(C1CCC(=O)NC1=O)C2=O
|
C18H15N3O5 353.334000 |
GQZPVHWKMSTKOI-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB422
|
Local ready
Direct docking supported
|
|
E3L065918
LIG000488
|
59
O=C1CCC(N2Cc3cc(NC(=O)c4cc5ccccc5o4)ccc3C2=O)C(=O)N1
|
C22H17N3O5 403.394000 |
GRDLGPVCCSHERU-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1202
|
Local ready
Direct docking supported
|
|
E3L065919
LIG000489
|
CC-3060
O=C1CCC(N2C(=O)c3cccc(NCc4cc5ccccc5o4)c3C2=O)C(=O)N1
|
C22H17N3O5 403.394000 |
GRICLJZNEMDVMA-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1039
|
Local ready
Direct docking supported
|
|
E3L065920
LIG000490
|
22
CC1(COc2ccc(C(C)(C)c3cc(Cl)c(OCC4CCN(C(=O)CCCCNc5ccc6c(c5)C(=O)N(C5CCC(=O)NC5=O)C6=O)CC4)c(C#N)c3)cc2)COC1
|
C45H50ClN5O8 824.375000 |
GRIRIBHJDGQONH-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1553
|
Local ready
Direct docking supported
|
|
E3L065921
LIG000491
|
CC4
O=C1NCCCC1N1C(=O)c2cccc(OCCOCCOCCOCc3ccccc3)c2C1=O
|
C26H30N2O7 482.533000 |
GRPCVZIUVZCWGX-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB403
|
Local ready
Direct docking supported
|
|
E3L065922
LIG000492
|
LIG000492
CN1CCN(c2ccc(NC3CCC(=O)NC3=O)cc2)CC1
|
C16H22N4O2 302.378000 |
GRQMMULSBXXEST-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, e3_ligand
BindingDB:BDBM575269; e3_ligand:62
|
Local ready
Direct docking supported
|
|
E3L065923
LIG000493
|
dALK-1-neg
COc1ccc(C(=O)CCC(=O)N2CCC(c3cc(OC(C)C)c(Nc4ncc(Cl)c(Nc5ccccc5S(=O)(=O)C(C)C)n4)cc3C)CC2)cc1
|
C39H46ClN5O6S 748.346000 |
GRQNGHHJZPOZFW-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1427
|
Local ready
Direct docking supported
|
|
E3L065924
LIG000494
|
CCT373566
C[C@H]1C[C@@H](O)CN(c2ncc(Cl)c(Nc3ccc4c(c3)c3c(c(=O)n4C)OCC(F)(F)[C@@H](C4CC4)N3)n2)C1
|
C26H29ClF2N6O3 547.006000 |
GSGDUDAFETZSPM-JWCWZOIMSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB26
Related BindingDB:BDBM50606292; Related BindingDB:BDBM50606290; Related BindingDB:BDBM50606293; Related BindingDB:BDBM50606291
|
Local ready
Direct docking supported
|
|
E3L065925
LIG000495
|
MG-Lin2
Cc1nnc2ccc(-c3cccc(N(C)C(=O)C4CCN(C(=O)/C=C/c5ccc(C(F)(F)F)cc5)CC4)c3)nn12
|
C29H27F3N6O2 548.569000 |
GSIHMNGUECFFIL-MDWZMJQESA-N | - | - |
MolGlueDB
MolGlueDB:MGDB418
|
Local ready
Direct docking supported
|
|
E3L065926
LIG000496
|
dALK-1
COc1ccc(C(=O)/C=C/C(=O)N2CCC(c3cc(OC(C)C)c(Nc4ncc(Cl)c(Nc5ccccc5S(=O)(=O)C(C)C)n4)cc3C)CC2)cc1
|
C39H44ClN5O6S 746.330000 |
GUGLEOOQEUDMHM-FOCLMDBBSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1426
|
Local ready
Direct docking supported
|