| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L066700
LIG001270
|
Z5000147067
CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc3c(c2)CN(C2CCC(=O)NC2=O)C3=O)cc1
|
C21H20N4O6S 456.480000 |
QRPYYGIYQSYWCJ-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB71
|
Local ready
Direct docking supported
|
|
E3L066701
LIG001271
|
cmp7d
O=C1CC(NC(=O)OCc2ccccc2)C(=O)N1
|
C12H12N2O4 248.238000 |
QRQMHYISDDHZBY-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB911
|
Local ready
Direct docking supported
|
|
E3L066702
LIG001272
|
NVS1.1
CS(=O)(=O)c1cc([C@H](N)c2ccccc2)c(Cl)cc1-c1ccn[nH]1
|
C17H16ClN3O2S 361.854000 |
QRSVLGKUUPUYFH-QGZVFWFLSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1442
|
Local ready
Direct docking supported
|
|
E3L066703
LIG001273
|
compound 22
CS(=O)(=O)c1cscc1-c1cn(C2CCC(=O)NC2=O)nn1
|
C12H12N4O4S2 340.386000 |
QRZMECZWSYOTRC-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB753
|
Local ready
Direct docking supported
|
|
E3L066704
LIG001274
|
9p
Cc1c(Cl)cc(NC(=O)CCc2ccc3c(c2)C(=O)N(C2CCC(=O)NC2=O)C3)cc1N1CC2(COC2)C1
|
C28H29ClN4O5 537.016000 |
QSMGQWGNPAJCEH-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB292
|
Local ready
Direct docking supported
|
|
E3L066705
LIG001275
|
EM12-SO2-C
Cc1cn(S(=O)(=O)c2ccc3c(c2)C(=O)N(C2CCC(=O)NC2=O)C3)c(=O)[nH]c1=O
|
C18H16N4O7S 432.414000 |
QTCPUQCPILDKJV-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, MolGlueDB
BindingDB:BDBM50630780; MolGlueDB:MGDB388
|
Local ready
Direct docking supported
|
|
E3L066706
LIG001276
|
1K
CC(C)(C)OC(=O)COc1ccc(-c2cccc3c2CN(C2CCC(=O)NC2=O)C3=O)cc1
|
C25H26N2O6 450.491000 |
QTMAEJXBOPPDRA-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB102
|
Local ready
Direct docking supported
|
|
E3L066707
LIG001277
|
DS22
CC[C@H](CO)Nc1nc(NCc2nc3cc(Cl)c(Cl)cc3[nH]2)c2ncn(-c3cnn(C)c3)c2n1
|
C21H22Cl2N10O 501.382000 |
QUGBKWYKYATQSZ-LLVKDONJSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB227
|
Local ready
Direct docking supported
|
|
E3L066708
LIG001278
|
LIG001278
CN1C(=O)CCC(N2Cc3ccccc3C2=O)C1=O
|
C14H14N2O3 258.277000 |
QURCPEBFVWXUKY-UHFFFAOYSA-N | Q96SW2 | - |
e3_ligand
e3_ligand:167
|
Local ready
Direct docking supported
|
|
E3L066709
LIG001279
|
HQ007
Cc1cnc(NC(=O)Cc2csc(Nc3cccc(N)n3)n2)s1
|
C14H14N6OS2 346.441000 |
QVRPMHDRWHSFIY-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB399
|
Local ready
Direct docking supported
|
|
E3L066710
LIG001280
|
9q
COCCN(C)c1cc(NC(=O)CCc2ccc3c(c2)C(=O)N(C2CCC(=O)NC2=O)C3)cc(Cl)c1C
|
C27H31ClN4O5 527.021000 |
QWBXGWZJXOHHJR-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB752
|
Local ready
Direct docking supported
|
|
E3L066711
LIG001281
|
LIG001281
Nc1cc(OS(=O)(=O)F)cc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O
|
C13H10FN3O7S 371.302000 |
QWMNVKROUGBTJO-UHFFFAOYSA-N | Q96SW2 | - |
e3_ligand
e3_ligand:103
|
Local ready
Direct docking supported
|
|
E3L066712
LIG001282
|
19
O=C1CCC(SCc2ccccc2)C(=O)N1
|
C12H13NO2S 235.308000 |
QWOOTRSQFSTMBW-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, MolGlueDB
BindingDB:BDBM581783; MolGlueDB:MGDB786
|
Local ready
Direct docking supported
|
|
E3L066713
LIG001283
|
EST1054
CN(C)C(=O)c1cc2cnc(Nc3ccc(N4CCN(C(=O)/C=C/c5ccccc5C(F)(F)F)CC4)cn3)nc2n1C1CCCC1
|
C33H35F3N8O2 632.691000 |
QWQZXTPQWYKQSG-SDNWHVSQSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB509
|
Local ready
Direct docking supported
|
|
E3L066714
LIG001284
|
8
CC(C)c1n[nH]c2c(NCc3ccc(-n4cccn4)cc3)nc(SCC(C)(C)O)nc12
|
C22H27N7OS 437.573000 |
QWZNYTVAUPABHB-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB142
|
Local ready
Direct docking supported
|
|
E3L066715
LIG001285
|
ZXH-1-086
O=C1CCC(N2Cc3c(NC(=O)CNc4ccnc(NCc5ccc6c(c5)OCO6)n4)cccc3C2=O)C(=O)N1
|
C27H25N7O6 543.540000 |
QXFBETUXJVKIFO-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, MolGlueDB
BindingDB:BDBM585776; MolGlueDB:MGDB1137
|
Local ready
Direct docking supported
|
|
E3L066716
LIG001286
|
LIG001286
CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@@H](N)C[C@H]1C(=O)N[C@@H]1CCCc2ccccc21)C1CCCCC1
|
C27H41N5O3 483.657000 |
QXPPEMGSZLSOPD-FOYXXMMASA-N | Q13490 | - |
e3_ligand
e3_ligand:104
|
Local ready
Direct docking supported
|
|
E3L066717
LIG001287
|
SJ7095
O=C1CCC(N2Cc3c(CNC(=O)c4ccc(F)cc4)cccc3C2=O)C(=O)N1
|
C21H18FN3O4 395.390000 |
QYERRCYEYNDQFV-UHFFFAOYSA-N | Q96SW2 | Protein cereblon |
BindingDB, MolGlueDB
BindingDB:BDBM730416; MolGlueDB:MGDB1092
|
Local ready
Direct docking supported
|
|
E3L066719
LIG001289
|
GBD-5
Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)nn2[C@H]1CCCN(C(=O)CCCCCCNc2ccc3c(c2)C(=O)N(C2CCC(=O)NC2=O)C3=O)C1
|
C42H43N9O6 769.863000 |
QZIMMMJAQZPBKN-YCIOTGQKSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB840
|
Local ready
Direct docking supported
|
|
E3L066720
LIG001290
|
6
O=C(O)COc1ccc(N2CCC(=O)NC2=O)cc1
|
C12H12N2O5 264.237000 |
QZLQKDIAPJHBAU-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1455
|
Local ready
Direct docking supported
|