| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L065684
LIG000254
|
9i
COc1ccc(C(=O)/C=C/C(=O)N2CCN(c3ccc(-n4nnc5c(=O)[nH]c6ccc(-c7ccc(OC)nc7)cc6c54)cc3C(F)(F)F)CC2)cc1
|
C37H30F3N7O5 709.685000 |
DBIQHRMAWALVBI-WYMLVPIESA-N | - | - |
MolGlueDB
MolGlueDB:MGDB656
|
Local ready
Direct docking supported
|
|
E3L065685
LIG000255
|
QXG-0632
O=C1CCC(N2Cc3cc(-c4cnc5ccccc5c4)ccc3C2=O)C(=O)N1
|
C22H17N3O3 371.396000 |
DBTUFNLLQDVGDB-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1168
|
Local ready
Direct docking supported
|
|
E3L065687
LIG000257
|
cmp31
NC(=O)c1ccc(N2CCN(Cc3ccc(COc4cccc5c4CN(C4CCC(=O)NC4=O)C5=O)cc3)CC2)nc1
|
C31H32N6O5 568.634000 |
DBZRRVVDMHIECD-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB775
|
Local ready
Direct docking supported
|
|
E3L065688
LIG000258
|
17a
CN1C(=O)CCC(CSc2ccccc2)C1=O
|
C13H15NO2S 249.335000 |
DCALUXGQDNMVKL-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB533
|
Local ready
Direct docking supported
|
|
E3L065689
LIG000259
|
VHL-SF2
Cc1cc([C@H](C(=O)N2C[C@H](S(=O)(=O)F)C[C@@H]2C(=O)N[C@@H](CC(=O)OC(C)(C)C)c2ccc(-c3scnc3C)cc2)C(C)C)on1
|
C31H39FN4O7S2 662.806000 |
DCGHVFWQHHOLKF-JPYYHWIRSA-N | P40337 | - |
e3_ligand
e3_ligand:127
|
Local ready
Direct docking supported
|
|
E3L065690
LIG000260
|
GBD-8
Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)nn2[C@H]1CCCN(C(=O)CCCCCCCCNc2ccc3c(c2)C(=O)N(C2CCC(=O)NC2=O)C3=O)C1
|
C44H47N9O6 797.917000 |
DCJYQURCBHSFEP-KIYCQYGCSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB837
|
Local ready
Direct docking supported
|
|
E3L065691
LIG000261
|
GBD-9
Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)nn2C1CCCN(C(=O)CCCCCCCCNc2ccc3c(c2)C(=O)N(C2CCC(=O)NC2=O)C3=O)C1
|
C44H47N9O6 797.917000 |
DCJYQURCBHSFEP-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB843
|
Local ready
Direct docking supported
|
|
E3L065692
LIG000262
|
DS59
Cc1nn(C)c(CNc2nc(NCc3ccc(-c4ccccn4)cc3)c3ncn(C(C)C)c3n2)c1S(N)(=O)=O
|
C26H30N10O2S 546.661000 |
DCNMIIRVWOSZDG-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1603
|
Local ready
Direct docking supported
|
|
E3L065693
LIG000263
|
Lib-C-6J
CN1C(=O)CCC(N2Cc3cc(-c4ccc(OCC(=O)N/N=C/c5c(C(F)(F)F)ccc(Cl)c5Cl)cc4)ccc3C2=O)C1=O
|
C30H23Cl2F3N4O5 647.437000 |
DCORTUZKSPUXBP-FIFHTESVSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB539
|
Local ready
Direct docking supported
|
|
E3L065694
LIG000264
|
40
O=C(NCc1ccc(-c2ccccn2)cc1)c1n[nH]cc1NC(=O)c1c(Cl)cccc1Cl
|
C23H17Cl2N5O2 466.328000 |
DCPUWHPUJFAXLO-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB881
|
Local ready
Direct docking supported
|
|
E3L065695
LIG000265
|
dALK-3
COc1ccc(C(=O)/C=C/C(=O)N2CCN(C3CCN(c4ccc(Nc5ncc(Cl)c(Nc6ccccc6P(C)(C)=O)n5)c(OC)c4)CC3)CC2)cc1
|
C39H45ClN7O5P 758.260000 |
DCTDXSOVOPNNQC-FOCLMDBBSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1430
|
Local ready
Direct docking supported
|
|
E3L065696
LIG000266
|
DS64
CC[C@H](CO)Nc1nc(NCc2nc3ccc(F)c(F)c3[nH]2)c2ncn(C(C)C)c2n1
|
C20H24F2N8O 430.463000 |
DCTODZNTFHJKGP-LLVKDONJSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1617
|
Local ready
Direct docking supported
|
|
E3L065697
LIG000267
|
9k
Cc1c(Cl)cc(NC(=O)CCc2ccc3c(c2)C(=O)N(C2CCC(=O)NC2=O)C3)cc1N1CCOCC1
|
C27H29ClN4O5 525.005000 |
DCWWHXBDVHWFFQ-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB297
|
Local ready
Direct docking supported
|
|
E3L065698
LIG000268
|
6
CC(C)(C)[C@H](NC(=O)c1cnn2c1OCCC2)C(=O)N1C[C@H](O)C[C@H]1C(=O)NCc1ccc(-c2ccccc2)cc1
|
C31H37N5O5 559.667000 |
DEAOEVVJHVQDDF-DMTNHVFBSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1451
|
Local ready
Direct docking supported
|
|
E3L065699
LIG000269
|
ZXH-1-155
O=C1CCC(N2Cc3c(NC4=NC(Nc5ccc6c(c5)OCCO6)NC=C4)cccc3C2=O)C(=O)N1
|
C25H24N6O5 488.504000 |
DEBSFTNSWYYRPE-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1154
|
Local ready
Direct docking supported
|
|
E3L065700
LIG000270
|
24
O=C1CCC(N2Cc3cc(NCc4ccc5ccc6cccc7ccc4c5c67)ccc3C2=O)C(=O)N1
|
C30H23N3O3 473.532000 |
DEHJLQBKFLXFQR-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1216
|
Local ready
Direct docking supported
|
|
E3L065701
LIG000271
|
Selinexor
O=C(/C=C\n1cnc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1)NNc1cnccn1
|
C17H11F6N7O 443.311000 |
DEVSOMFAQLZNKR-RJRFIUFISA-N | - | - |
MolGlueDB
MolGlueDB:MGDB852
|
Local ready
Direct docking supported
|
|
E3L065702
LIG000272
|
EN884
C=CC(=O)N1CCC(Cc2ccccn2)CC1
|
C14H18N2O 230.311000 |
DFQDQRLZIBXXOA-UHFFFAOYSA-N | P63208 | - |
e3_ligand
e3_ligand:108
|
Local ready
Direct docking supported
|
|
E3L065703
LIG000273
|
LIG000273
O=C1CCC(N2C(=O)c3cc4c(cc3C2=O)CNC4)C(=O)N1
|
C15H13N3O4 299.286000 |
DFRCTMCXNOBCLU-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, e3_ligand
BindingDB:BDBM50618118; e3_ligand:75
|
Local ready
Direct docking supported
|
|
E3L065704
LIG000274
|
21
O=C1CCC(N2Cc3cc(NC4=NN=C5C=CC=CC54)ccc3C2=O)C(=O)N1
|
C20H17N5O3 375.388000 |
DFWFWUACKACIKL-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1080
|
Local ready
Direct docking supported
|