| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L045921
BDB045921
|
BDBM50109109
CC[C@H](Cc1ccc(OC)c(C(=O)NCc2ccc(C(F)(F)F)cc2)c1)C(=O)O
|
C21H22F3NO4 409.404000 |
YSFRXMSOTXOZQZ-OAHLLOKOSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50109109; PubChem:CID10341444
|
Local ready
Direct docking supported
|
|
E3L045922
BDB045922
|
Kcl-1999000269
CC[C@@H](Cc1ccc(OC)c(C(=O)NCc2ccc(C(F)(F)F)cc2)c1)C(=O)O
|
C21H22F3NO4 409.404000 |
YSFRXMSOTXOZQZ-HNNXBMFYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50109110; PubChem:CID10341445
|
Local ready
Direct docking supported
|
|
E3L045923
BDB045923
|
BDBM50109158
CC(C)(C)c1ccc(CNC(=O)c2ccc(NC(=O)c3cccc(CN4C(=O)OC[C@H]4Cc4ccccc4)c3)cc2)cc1
|
C36H37N3O4 575.709000 |
XVJCPFOBKZATEY-JGCGQSQUSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50109158; PubChem:CID90469357
|
Local ready
Direct docking supported
|
|
E3L045924
BDB045924
|
BDBM50109159
O=C(NCc1ccccc1)c1ccc(NC(=O)c2cccc(CN3C(=O)OC[C@H]3Cc3ccccc3)c2)cc1
|
C32H29N3O4 519.601000 |
QXPGDMOHKPEQDS-GDLZYMKVSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50109159; PubChem:CID90469423
|
Local ready
Direct docking supported
|
|
E3L045925
BDB045925
|
BDBM50109160
CCCCCC(=O)Nc1ccc(C(=O)Nc2cccc(C[C@H](C)C(=O)O)c2)cc1
|
C23H28N2O4 396.487000 |
QGBDJBQHHKZURZ-INIZCTEOSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50109160; PubChem:CID122184723
|
Local ready
Direct docking supported
|
|
E3L045926
BDB045926
|
BDBM50109161
C[C@@H](Cc1cccc(NC(=O)c2ccc(NC(=O)Cc3ccc(C(C)(C)C)cc3)cc2)c1)C(=O)O
|
C29H32N2O4 472.585000 |
QLYKQZVYUDGFFR-IBGZPJMESA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50109161; PubChem:CID122184722
|
Local ready
Direct docking supported
|
|
E3L045927
BDB045927
|
BDBM50109162
CCCCCC(=O)Nc1ccc(C(=O)Nc2cccc(C[C@H](C)C(=O)N3C(=O)OC[C@H]3Cc3ccccc3)c2)cc1
|
C33H37N3O5 555.675000 |
MXGAPSURGHJIRP-MUAVYFROSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50109162; PubChem:CID122184721
|
Local ready
Direct docking supported
|
|
E3L045928
BDB045928
|
BDBM50109163
C[C@@H](Cc1cccc(NC(=O)c2ccc(NC(=O)Cc3ccc(C(C)(C)C)cc3)cc2)c1)C(=O)N1C(=O)OC[C@H]1Cc1ccccc1
|
C39H41N3O5 631.773000 |
HVYFWWFTKGRBIY-UVMFRMCBSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50109163; PubChem:CID122184720
|
Local ready
Direct docking supported
|
|
E3L045929
BDB045929
|
BDBM50109164
CCCCCNC(=O)c1ccc(NC(=O)c2cccc(CN3C(=O)OC[C@@H]3Cc3ccccc3)c2)cc1
|
C30H33N3O4 499.611000 |
MZEDRPVZWIJFGP-MHZLTWQESA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50109164; PubChem:CID122184719
|
Local ready
Direct docking supported
|
|
E3L045930
BDB045930
|
BDBM50109165
O=C(NCc1ccc(C(F)(F)F)cc1)c1ccc(NC(=O)c2cccc(CN3C(=O)OC[C@@H]3Cc3ccccc3)c2)cc1
|
C33H28F3N3O4 587.598000 |
TYIAGOIUAXCVPG-LJAQVGFWSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50109165; PubChem:CID122184718
|
Local ready
Direct docking supported
|
|
E3L045931
BDB045931
|
BDBM50109166
CC(C)(C)c1ccc(CNC(=O)c2ccc(NC(=O)c3cccc(CN4C(=O)OC[C@@H]4Cc4ccccc4)c3)cc2)cc1
|
C36H37N3O4 575.709000 |
XVJCPFOBKZATEY-YTTGMZPUSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50109166; PubChem:CID122184717
|
Local ready
Direct docking supported
|
|
E3L045932
BDB045932
|
BDBM50109196
O=C(NCC1CCCCC1)c1ccc(NC(=O)c2cccc(CN3C(=O)OC[C@H]3Cc3ccccc3)c2)cc1
|
C32H35N3O4 525.649000 |
ZUPZVOKXJYNBAD-GDLZYMKVSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50109196; PubChem:CID90469424
|
Local ready
Direct docking supported
|
|
E3L045933
BDB045933
|
BDBM50109198
O=C(Nc1ccc(C(=O)NC2CC2)cc1)c1cccc(CN2C(=O)OC[C@H]2Cc2ccccc2)c1
|
C28H27N3O4 469.541000 |
QUSSDNYXUHZONQ-RUZDIDTESA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50109198; PubChem:CID90469426
|
Local ready
Direct docking supported
|
|
E3L045934
BDB045934
|
BDBM50109199
CCCCCCCCCCCCNC(=O)c1ccc(NC(=O)c2cccc(CN3C(=O)OC[C@H]3Cc3ccccc3)c2)cc1
|
C37H47N3O4 597.800000 |
KUYBUYXZVCDEPQ-UUWRZZSWSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50109199; PubChem:CID90469425
|
Local ready
Direct docking supported
|
|
E3L045935
BDB045935
|
BDBM50109200
CCCCCNC(=O)c1ccc(NC(=O)c2cccc(CN3C(=O)OC[C@H]3Cc3ccccc3)c2)cc1
|
C30H33N3O4 499.611000 |
MZEDRPVZWIJFGP-HHHXNRCGSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50109200; PubChem:CID86582930
|
Local ready
Direct docking supported
|
|
E3L045936
BDB045936
|
BDBM50109262
O=C(NCc1ccc(C(F)(F)F)cc1)c1ccc(NC(=O)c2cccc(CN3C(=O)OC[C@H]3Cc3ccccc3)c2)cc1
|
C33H28F3N3O4 587.598000 |
TYIAGOIUAXCVPG-GDLZYMKVSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50109262; PubChem:CID90469358
|
Local ready
Direct docking supported
|
|
E3L045937
BDB045937
|
BDBM50109368
CC(=O)Nc1ccc(S(=O)(=O)N(CC(=O)O)c2ccc(N(CC(=O)O)S(=O)(=O)c3ccc(NC(C)=O)cc3)c3ccccc23)cc1
|
C30H28N4O10S2 668.706000 |
JJOFXZVJJGEQCK-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50109368; PubChem:CID122184781
|
Local ready
Direct docking supported
|
|
E3L045938
BDB045938
|
BDBM50109398
O=C(O)[C@H]1CCCC[C@H]1C(=O)N1CCc2ccccc2[C@H]1CN1C(=O)c2ccccc2C1=O
|
C26H26N2O5 446.503000 |
LNENLABLFGGAFF-BHIFYINESA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50109398; PubChem:CID56840728
|
Local ready
Direct docking supported
|
|
E3L045939
BDB045939
|
BDBM50109403
COc1ccc(S(=O)(=O)N(CC(=O)O)c2ccc(N(CC(=O)O)S(=O)(=O)c3ccc(OC)cc3)c(OC)c2)cc1
|
C25H26N2O11S2 594.620000 |
PHZBSENPMPRYCX-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50109403; PubChem:CID122184776
|
Local ready
Direct docking supported
|
|
E3L045940
BDB045940
|
BDBM50109528
C=CC(=O)Nc1cccc(CNc2nc(Nc3cnn(CCOC)c3)ncc2Cl)c1
|
C20H22ClN7O2 427.896000 |
MTDJJMFQQXOEPJ-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM50109528; PubChem:CID118475652
|
Local ready
Direct docking supported
|