| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L055181
BDB055181
|
BDBM50402224
CC(C)CC(CC(C)C)NC(=O)[C@@H]1CNC[C@H](N2CC(=O)N(c3ccccc3Cl)CC2(C)C)C1
|
C27H43ClN4O2 491.120000 |
VVEBLTKFUFYNOR-RBBKRZOGSA-N | P00797 | Renin |
BindingDB, PubChem
BindingDB:BDBM50402224; PubChem:CID70679351
|
Local ready
Direct docking supported
|
|
E3L055182
BDB055182
|
BDBM50402225
CC[C@H](CC(C)C)NC(=O)[C@@H]1CNC[C@H](N2CC(=O)N(c3ccccc3Cl)CC2(C)C)C1
|
C25H39ClN4O2 463.066000 |
LUUUJDHKZGQUKY-XUVXKRRUSA-N | P00797 | Renin |
BindingDB, PubChem
BindingDB:BDBM50402225; PubChem:CID50913994
|
Local ready
Direct docking supported
|
|
E3L055183
BDB055183
|
BDBM50402226
CC(C)CCNC(=O)[C@@H]1CNC[C@H](N2CC(=O)N(c3ccccc3Cl)CC2(C)C)C1
|
C23H35ClN4O2 435.012000 |
OIPASSZLGANZOF-ZWKOTPCHSA-N | P00797 | Renin |
BindingDB, PubChem
BindingDB:BDBM50402226; PubChem:CID70679350
|
Local ready
Direct docking supported
|
|
E3L055184
BDB055184
|
BDBM50402227
CC(C)CCNC(=O)[C@@H]1CNC[C@H](CN2CC(=O)N(c3ccccc3Cl)CC2(C)C)C1
|
C24H37ClN4O2 449.039000 |
XGYKQWJDBJCEAW-MOPGFXCFSA-N | P00797 | Renin |
BindingDB, PubChem
BindingDB:BDBM50402227; PubChem:CID70679349
|
Local ready
Direct docking supported
|
|
E3L055185
BDB055185
|
BDBM50402228
CC(C)CCNC(=O)[C@@H]1CNC[C@H](C(=O)N2CC(=O)N(c3ccccc3Cl)CC2(C)C)C1
|
C24H35ClN4O3 463.022000 |
NLJHWBFWYCTFNJ-ZWKOTPCHSA-N | P00797 | Renin |
BindingDB, PubChem
BindingDB:BDBM50402228; PubChem:CID71462969
|
Local ready
Direct docking supported
|
|
E3L055186
BDB055186
|
2'-Hydroxy-4,4',5',6'-tetramethoxychalcone
COc1ccc(/C=C/C(=O)c2c(O)cc(OC)c(OC)c2OC)cc1
|
C19H20O6 344.363000 |
FRISOFZUHCOQEC-JXMROGBWSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50403019; PubChem:CID6253276
|
Local ready
Direct docking supported
|
|
E3L055187
BDB055187
|
BDBM50403055
CCNc1cc(O)c2c(c1)CCCC(=O)C(=O)C(=O)CC[C@H](C)[C@H](C)OC2=O
|
C21H27NO6 389.448000 |
CVMRXEUTOZUOID-STQMWFEESA-N | Q13233 | Mitogen-activated protein kinase kinase kinase 1 |
BindingDB, PubChem
BindingDB:BDBM50403055; PubChem:CID91496473
|
Local ready
Direct docking supported
|
|
E3L055188
BDB055188
|
BDBM50403301
CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O
|
C82H123N19O27 1806.992000 |
RZAWLWZKYNTTQL-RZDGSAQYSA-N | O15151, Q00987 | Protein Mdm4, E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50403301; PubChem:CID145987298
|
Local ready
Direct docking supported
|
|
E3L055189
BDB055189
|
MDM2/MDMX Inhibitor ATSP-7041
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCCCC/C=C/CCC[C@@](C)(C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(N)=O)NC(=O)[C@H](CC2CCC2)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CCC(=O)O)NC1=O)[C@@H](C)O
|
C87H125N17O21 1745.055000 |
UEOCESQEOWHKDQ-HMWZRHKHSA-N | O15151, Q00987 | Protein Mdm4, E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50403302; PubChem:CID71680616
|
Local ready
Direct docking supported
|
|
E3L055190
BDB055190
|
H-Leu-Thr-Phe-Glu-His-Tyr-Trp-Ala-Gln-Glu-Thr-Ser-OH
CC(C)C[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O
|
C70H94N16O22 1511.612000 |
YQZCVINPOZDEDZ-YXDRAXQRSA-N | O15151, Q00987 | E3 ubiquitin-protein ligase Mdm2, Protein Mdm4 |
BindingDB, PubChem
BindingDB:BDBM50403303; PubChem:CID171346047
|
Local ready
Direct docking supported
|
|
E3L055191
BDB055191
|
BDBM50403304
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)O
|
C74H99N17O21 1562.704000 |
NQSNGPBHIPKMKT-LEEWRXQBSA-N | O15151 | Protein Mdm4 |
BindingDB
BindingDB:BDBM50403304
|
Local ready
Direct docking supported
|
|
E3L055192
BDB055192
|
BDBM50403305
CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCCCC/C=C\CCC[C@@](C)(C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC1=O)[C@@H](C)O
|
C98H153N27O25 2109.466000 |
DFSDBFJUWANYES-UBWKHRTASA-N | O15151, Q00987 | Protein Mdm4, E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50403305
|
Local ready
Direct docking supported
|
|
E3L055193
BDB055193
|
BDBM50403306
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCCCC/C=C\CCC[C@@](C)(C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC1=O)[C@@H](C)O
|
C99H153N21O27 2069.433000 |
YOLLBQVCQMKTEN-DZKTVICBSA-N | O15151, Q00987 | E3 ubiquitin-protein ligase Mdm2, Protein Mdm4 |
BindingDB
BindingDB:BDBM50403306
|
Local ready
Direct docking supported
|
|
E3L055194
BDB055194
|
BDBM50403367
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCCCC/C=C\CCC[C@@](C)(C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC1=O)[C@@H](C)O
|
C98H149N21O29 2085.388000 |
SOTXVDFJHYKWOG-NJUAEABQSA-N | O15151, Q00987 | Protein Mdm4, E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50403367
|
Local ready
Direct docking supported
|
|
E3L055195
BDB055195
|
BDBM50403368
O=C(CN(Cc1ccc(Cl)cc1)C(=O)c1cc2ccccc2[nH]1)NC1CCCCC1
|
C24H26ClN3O2 423.944000 |
CRTGTKRROZUQTQ-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50403368; PubChem:CID102361053
|
Local ready
Direct docking supported
|
|
E3L055196
BDB055196
|
BDBM50403369
CC(C)N(CC(N)=O)C(=O)c1cc2c(N(C)C)nc(NCCc3c[nH]c4ccccc34)nc2n1CCCc1ccc(Cl)cc1Cl
|
C33H38Cl2N8O2 649.627000 |
DGYXXVVLRDGURB-UHFFFAOYSA-N | O15151, Q00987 | E3 ubiquitin-protein ligase Mdm2, Protein Mdm4 |
BindingDB, PubChem
BindingDB:BDBM50403369; PubChem:CID171342552
|
Local ready
Direct docking supported
|
|
E3L055197
BDB055197
|
BDBM50403370
CC(C)C[C@H](C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
|
C51H76N8O9 945.216000 |
YHLJEWZZOJLRNJ-CJAFUUPZSA-N | P00797 | Renin |
BindingDB
BindingDB:BDBM50403370
|
Local ready
Direct docking supported
|
|
E3L055198
BDB055198
|
BDBM50403372
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCCCC/C=C/CCC[C@@](C)(C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C)C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)NC1=O)[C@@H](C)O
|
C90H133N19O20 1801.167000 |
HZZIKEHDARTUPE-PUZYHYNUSA-N | O15151, Q00987 | E3 ubiquitin-protein ligase Mdm2, Protein Mdm4 |
BindingDB
BindingDB:BDBM50403372
|
Local ready
Direct docking supported
|
|
E3L055199
BDB055199
|
BDBM50403482
Cc1c(Cl)ccc2c(/C=C3\NC(=O)N(Cc4ccc(F)c(F)c4)C3=O)c[nH]c12
|
C20H14ClF2N3O2 401.800000 |
OEXMEVPQEPHTAQ-IDUWFGFVSA-N | O15151, Q00987 | E3 ubiquitin-protein ligase Mdm2, Protein Mdm4 |
BindingDB
BindingDB:BDBM50403482
|
Local ready
Direct docking supported
|
|
E3L055200
BDB055200
|
BDBM50403525
Cc1c(Cl)ccc2c(/C=C3\NC(=O)N(C(C(=O)NC(CO)CO)c4ccc(F)c(F)c4)C3=O)c[nH]c12
|
C24H21ClF2N4O5 518.904000 |
ZFYQBPVMECJUBO-GXHLCREISA-N | O15151, Q00987 | E3 ubiquitin-protein ligase Mdm2, Protein Mdm4 |
BindingDB
BindingDB:BDBM50403525
|
Local ready
Direct docking supported
|