| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L007261
BDB007261
|
BDBM162139
CNC(=O)CN[C@H]1CC[C@H](CN(C)c2ccc(N3C(=O)Cc4cc(OC)c(OC(C)C)cc4[C@@H]3c3ccc(Cl)cc3)nc2)CC1
|
C35H44ClN5O4 634.221000 |
XOJSJNMPMVGIEX-TWCVDLNQSA-N | O15151, Q00987 | E3 ubiquitin-protein ligase Mdm2, Protein Mdm4 |
BindingDB
BindingDB:BDBM162139
|
Local ready
Direct docking supported
|
|
E3L007262
BDB007262
|
BDBM162140
COc1cc2c(cc1OC(C)C)[C@H](c1ccc(Cl)cc1)N(c1ccc(N(C)CC3CCC(N4CCNC(=O)C4)CC3)cn1)C(=O)C2
|
C36H44ClN5O4 646.232000 |
ATBRFGBPELIIFJ-ZUWXBNTRSA-N | O15151, Q00987 | E3 ubiquitin-protein ligase Mdm2, Protein Mdm4 |
BindingDB, PubChem
BindingDB:BDBM162140; PubChem:CID67390280
|
Local ready
Direct docking supported
|
|
E3L007263
BDB007263
|
BDBM162141
COc1cc2c(cc1OC(C)C)[C@H](c1ccc(Cl)cc1)N(c1ccc(N(C)C[C@H]3CC[C@H](N4CC(=O)N(C)C4)CC3)cn1)C(=O)C2
|
C36H44ClN5O4 646.232000 |
DPPMYLOYLBNZNP-BXKNEMSHSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM162141
|
Local ready
Direct docking supported
|
|
E3L007264
BDB007264
|
BDBM162142
COc1cc2c(cc1OC(C)C)[C@H](c1ccc(Cl)cc1)N(c1ccc(N(C)C[C@H]3CC[C@H](N4CCN(C)C(=O)C4)CC3)cn1)C(=O)C2
|
C37H46ClN5O4 660.259000 |
QCZBNRNLGNLUDF-YFMCWZQFSA-N | O15151, Q00987 | E3 ubiquitin-protein ligase Mdm2, Protein Mdm4 |
BindingDB
BindingDB:BDBM162142
|
Local ready
Direct docking supported
|
|
E3L007265
BDB007265
|
BDBM162147
COc1cc2c(cc1OC(C)C)[C@H](c1ccc(Cl)cc1)N(c1ccc(N(C)C[C@H]3CC[C@H](N4CCN(C)C(=O)C4)CC3)nc1)C(=O)C2
|
C37H46ClN5O4 660.259000 |
VZDNISKFMYZWGF-YFMCWZQFSA-N | O15151, Q00987 | Protein Mdm4, E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM162147
|
Local ready
Direct docking supported
|
|
E3L007266
BDB007266
|
BDBM162151
CCN1CN([C@H]2CC[C@H](CN(C)c3ccc(N4C(=O)Cc5cc(OC)c(OC(C)C)cc5[C@@H]4c4ccc(Cl)cc4)cn3)CC2)CC1=O
|
C37H46ClN5O4 660.259000 |
SCYOOAARUYQRGU-YFMCWZQFSA-N | O15151, Q00987 | Protein Mdm4, E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM162151
|
Local ready
Direct docking supported
|
|
E3L007267
BDB007267
|
BDBM162157
COc1cc2c(cc1OC(C)C)[C@H](c1ccc(Cl)cc1)N(c1cnc(N(C)C[C@H]3CC[C@H](N4CCN(C)C(=O)C4)CC3)cn1)C(=O)C2
|
C36H45ClN6O4 661.247000 |
PNRKMBJQIFDKIH-BXKNEMSHSA-N | O15151, Q00987 | Protein Mdm4, E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM162157
|
Local ready
Direct docking supported
|
|
E3L007268
BDB007268
|
BDBM162165
COc1cc2c(cc1OC(C)C)[C@H](c1ccc(Cl)cc1)N(c1ccc(N(C)C[C@H]3CC[C@H](N4CC(=O)N(C(C)C)C4)CC3)cn1)C(=O)C2
|
C38H48ClN5O4 674.286000 |
TVDJAVZCIXBVDN-ZLDXLSBDSA-N | O15151, Q00987 | Protein Mdm4, E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM162165
|
Local ready
Direct docking supported
|
|
E3L007269
BDB007269
|
BDBM162166
COc1cc2c(cc1OC(C)C)[C@H](c1ccc(Cl)cc1)N(c1cnc(N(C)C[C@H]3CC[C@H](N4CC(=O)N(C)C4)CC3)cn1)C(=O)C2
|
C35H43ClN6O4 647.220000 |
MTVMVQKGJODTNB-TWCVDLNQSA-N | O15151, Q00987 | E3 ubiquitin-protein ligase Mdm2, Protein Mdm4 |
BindingDB
BindingDB:BDBM162166
|
Local ready
Direct docking supported
|
|
E3L007270
BDB007270
|
BDBM162195
COc1cc2c(cc1OC(C)C)[C@H](c1ccc(Cl)cc1)N(c1ccc([C@H](C)N3CCNCC3=O)cc1)C(=O)C2
|
C31H34ClN3O4 548.083000 |
AJYCGDGWEQCZPL-GEFUHLBYSA-N | O15151, Q00987 | E3 ubiquitin-protein ligase Mdm2, Protein Mdm4 |
BindingDB, PubChem
BindingDB:BDBM162195; PubChem:CID58438042
|
Local ready
Direct docking supported
|
|
E3L007271
BDB007271
|
BDBM162209
COc1cc2c(cc1OC(C)C)[C@H](c1ccc(Cl)cc1)N(c1ccc([C@H](C)NC(C)=O)cc1)C(=O)C2
|
C29H31ClN2O4 507.030000 |
JYVXYJKPEZKEFC-YRVHBCJASA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM162209; PubChem:CID67390221
|
Local ready
Direct docking supported
|
|
E3L007272
BDB007272
|
BDBM162221
COc1cc2c(cc1OC1CCC1)[C@H](c1ccc(Cl)cc1)N(c1ccc(N(C)C[C@H]3CC[C@H](N4CC(=O)N(C)C4)CC3)nc1)C(=O)C2
|
C37H44ClN5O4 658.243000 |
VHLWJMNUKMJHDC-JFRGOZQMSA-N | O15151, Q00987 | Protein Mdm4, E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM162221
|
Local ready
Direct docking supported
|
|
E3L007273
BDB007273
|
BDBM162222
COc1cc2c(cc1OCC1CCCO1)[C@H](c1ccc(Cl)cc1)N(c1ccc(N(C)C[C@H]3CC[C@H](N4CC(=O)N(C)C4)CC3)nc1)C(=O)C2
|
C38H46ClN5O5 688.269000 |
SWAFNVMILLLOBL-XGAULQKSSA-N | O15151, Q00987 | Protein Mdm4, E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM162222
|
Local ready
Direct docking supported
|
|
E3L007274
BDB007274
|
BDBM162234
COc1cc2c(cc1OC(C)C)[C@H](c1ccc(Cl)cc1)N(c1ccc([C@H](C)N3CCN(C(C)=O)CC3=O)cc1)C(=O)C2
|
C33H36ClN3O5 590.120000 |
NWEHVDGEHGVRRN-VTLMBFNKSA-N | O15151, Q00987 | Protein Mdm4, E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM162234; PubChem:CID58437790
|
Local ready
Direct docking supported
|
|
E3L007275
BDB007275
|
Thrombin inhibitor 6
CC(C)(C)C(=O)n1nc(-c2ccc[nH]c2=O)cc1NCc1ccc(Cl)s1
|
C18H19ClN4O2S 390.896000 |
IELDEMOVCFANHT-UHFFFAOYSA-N | P00748 | Coagulation factor XII |
BindingDB, PubChem
BindingDB:BDBM162366; PubChem:CID136314017
|
Local ready
Direct docking supported
|
|
E3L007276
BDB007276
|
BDBM163407
COc1ccccc1C(=O)n1nc(-c2ccccn2)cc1NCc1ccc(Cl)s1
|
C21H17ClN4O2S 424.913000 |
CPBDFCXKCBYWQN-UHFFFAOYSA-N | P00748 | Coagulation factor XII |
BindingDB, PubChem
BindingDB:BDBM163407; PubChem:CID133081351
|
Local ready
Direct docking supported
|
|
E3L007277
BDB007277
|
BDBM164883
COc1cc(F)ccc1-c1ccnc(NC(=O)[C@H]2CCC[C@@H](NC(C)=O)C2)c1
|
C21H24FN3O3 385.439000 |
QNWXRLPZIFMTBK-DOTOQJQBSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM164883; PubChem:CID53373586
|
Local ready
Direct docking supported
|
|
E3L007278
BDB007278
|
BDBM164884
COc1cc(F)ccc1-c1ccnc(NC(=O)C2CCC(NC(C)=O)C2)c1
|
C20H22FN3O3 371.412000 |
FUMJKSZLZJFCAQ-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM164884; PubChem:CID76029028
|
Local ready
Direct docking supported
|
|
E3L007279
BDB007279
|
5,6-Dihydro-6-oxophenanthridine-3-carboxylic acid
O=C(O)c1ccc2c(c1)[nH]c(=O)c1ccccc12
|
C14H9NO3 239.230000 |
QCZYYHNRVZRTGW-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM165198; PubChem:CID217664
|
Local ready
Direct docking supported
|
|
E3L007280
BDB007280
|
BDBM165199
O=C(O)c1ccc2c3ccccc3c(=O)n(CCCO)c2c1
|
C17H15NO4 297.310000 |
KDOUIRSARHGGIV-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM165199; PubChem:CID57664143
|
Local ready
Direct docking supported
|