| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L047501
BDB047501
|
BDBM50176625
CCC(C(=O)O)C1CCc2cc(OCCn3ncc4ccccc4c3=O)ccc21
|
C23H24N2O4 392.455000 |
NRMZHZYCKVOUPX-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50176625; PubChem:CID44406365
|
Local ready
Direct docking supported
|
|
E3L047502
BDB047502
|
BDBM50176626
CCC(C(=O)O)C1CCc2cc(OCCc3nc(C4CCCC4)oc3C)ccc21
|
C24H31NO4 397.515000 |
JUGJRTWWYZTNAY-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50176626; PubChem:CID10157662
|
Local ready
Direct docking supported
|
|
E3L047503
BDB047503
|
BDBM50176627
CCC(C(=O)O)C1CCc2cc(OCCc3coc(-c4ccccc4)n3)ccc21
|
C24H25NO4 391.467000 |
SCMGKSLIQWBTDQ-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50176627; PubChem:CID21942737
|
Local ready
Direct docking supported
|
|
E3L047504
BDB047504
|
BDBM50176628
CCC(C(=O)O)C1CCc2cc(OCCc3c(C)noc3C)ccc21
|
C20H25NO4 343.423000 |
CBEWCJJVGVJDMZ-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50176628; PubChem:CID44406345
|
Local ready
Direct docking supported
|
|
E3L047505
BDB047505
|
BDBM50176629
Cc1oc(-c2ccccc2)nc1CCOc1ccc2c(c1)CCC2C(CC(F)(F)F)C(=O)O
|
C25H24F3NO4 459.464000 |
UIDIPZWJYQJSDR-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50176629; PubChem:CID44406336
|
Local ready
Direct docking supported
|
|
E3L047506
BDB047506
|
BDBM50176630
Cc1oc(-c2ccccc2)nc1CCOc1ccc2c(c1)CCC2C(C)C(=O)O
|
C24H25NO4 391.467000 |
RHCUEKCLUOBRJM-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50176630; PubChem:CID21942723
|
Local ready
Direct docking supported
|
|
E3L047507
BDB047507
|
BDBM50176631
CCC(C(=O)O)C1CCc2cc(OCCc3nc(-c4ccccc4)oc3C)ccc21
|
C25H27NO4 405.494000 |
XQWUEDSGGNBHSG-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50176631; PubChem:CID10294697
|
Local ready
Direct docking supported
|
|
E3L047508
BDB047508
|
BDBM50176632
CCC(C(=O)O)C1CCc2cc(OCCNC(=O)Nc3ccc(C)cc3)ccc21
|
C23H28N2O4 396.487000 |
CYAXXSZDGPTFBI-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50176632; PubChem:CID44406258
|
Local ready
Direct docking supported
|
|
E3L047509
BDB047509
|
BDBM50176633
CCC(C(=O)O)C1CCc2cc(OCCc3nc(-c4ccccc4F)oc3C)ccc21
|
C25H26FNO4 423.484000 |
HPTWYTJROHXJTH-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50176633; PubChem:CID44406172
|
Local ready
Direct docking supported
|
|
E3L047510
BDB047510
|
BDBM50176634
CC[C@@H](C(=O)O)[C@H]1CCc2cc(OCCc3nc(-c4ccc(Cl)c(Cl)c4)oc3C)ccc21
|
C25H25Cl2NO4 474.384000 |
SJYFDJBDUNUHJQ-UYAOXDASSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50176634; PubChem:CID44406455
|
Local ready
Direct docking supported
|
|
E3L047511
BDB047511
|
BDBM50176635
CC[C@H](C(=O)O)[C@H]1CCc2cc(OCCc3nc(-c4ccc(C)cc4)oc3C)ccc21
|
C26H29NO4 419.521000 |
PVTZPAMEGKOLDH-JTHBVZDNSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50176635; PubChem:CID44406411
|
Local ready
Direct docking supported
|
|
E3L047512
BDB047512
|
BDBM50176636
CCOC(C(=O)O)C1CCc2cc(OCCc3nc(-c4ccccc4)oc3C)ccc21
|
C25H27NO5 421.493000 |
ANSOPDAAFLKBAI-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50176636; PubChem:CID21942781
|
Local ready
Direct docking supported
|
|
E3L047513
BDB047513
|
BDBM50176637
CC[C@H](C(=O)O)[C@@H]1CCc2cc(OCCc3nc(-c4ccc(Cl)c(Cl)c4)oc3C)ccc21
|
C25H25Cl2NO4 474.384000 |
SJYFDJBDUNUHJQ-ICSRJNTNSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50176637; PubChem:CID44406482
|
Local ready
Direct docking supported
|
|
E3L047514
BDB047514
|
BDBM50176638
CCC(C(=O)O)C1CCc2cc(OCc3nc(-c4ccccc4)oc3C(F)(F)F)ccc21
|
C24H22F3NO4 445.437000 |
ISTCWLKALCYQEN-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50176638; PubChem:CID44406263
|
Local ready
Direct docking supported
|
|
E3L047515
BDB047515
|
BDBM50176639
CCC(C(=O)O)C1CCc2cc(OCCc3nc(-c4cccc(C)c4)oc3C)ccc21
|
C26H29NO4 419.521000 |
ANZBIERYZKGLBF-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50176639; PubChem:CID10223837
|
Local ready
Direct docking supported
|
|
E3L047516
BDB047516
|
BDBM50176640
Cc1oc(-c2ccccc2)nc1CCOc1ccc2c(c1)CCC2C(C(=O)O)c1ccccc1
|
C29H27NO4 453.538000 |
KTOFVXDFZOKLJO-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50176640; PubChem:CID44406283
|
Local ready
Direct docking supported
|
|
E3L047517
BDB047517
|
BDBM50176641
CCC(C(=O)O)C1CCc2cc(OCCc3nc(-c4cccc(C(F)(F)F)c4)oc3C)ccc21
|
C26H26F3NO4 473.491000 |
HHYHQMCULLJUOU-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50176641; PubChem:CID10140247
|
Local ready
Direct docking supported
|
|
E3L047518
BDB047518
|
BDBM50176642
CCC(C(=O)O)C1CCc2cc(OCCc3nc(-c4ccccc4)oc3C)c(-c3ccc(Cl)cc3)cc21
|
C31H30ClNO4 516.037000 |
BYQLMKIVHJIOJT-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50176642; PubChem:CID10186118
|
Local ready
Direct docking supported
|
|
E3L047519
BDB047519
|
BDBM50176643
CCC(C(=O)O)C1CCc2cc(OCCc3nc(-c4ccc(C(C)(C)C)cc4)oc3C)ccc21
|
C29H35NO4 461.602000 |
LDACFVHWDBQOOJ-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50176643; PubChem:CID10139551
|
Local ready
Direct docking supported
|
|
E3L047520
BDB047520
|
BDBM50176644
CCC(C(=O)O)C1CCc2cc(OCCc3nc(-c4ccc5c(c4)OCC5)oc3C)ccc21
|
C27H29NO5 447.531000 |
LKYMFRWHOPVHEU-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50176644; PubChem:CID10204076
|
Local ready
Direct docking supported
|