| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L048641
BDB048641
|
BDBM50213328
Cc1cc(OCc2cc(-c3ccc(C(F)(F)F)cc3)on2)cc2scc(CC(=O)O)c12
|
C22H16F3NO4S 447.434000 |
ONHPYXIGAYSAKE-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50213328; PubChem:CID22504815
|
Local ready
Direct docking supported
|
|
E3L048642
BDB048642
|
BDBM50213329
Cc1cc2c(CC(=O)O)csc2cc1OCc1sc(-c2ccc(C(F)(F)F)cc2)nc1C
|
C23H18F3NO3S2 477.529000 |
HEJBWSQANOAUTK-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50213329; PubChem:CID44432398
|
Local ready
Direct docking supported
|
|
E3L048643
BDB048643
|
BDBM50213330
O=C(O)Cc1csc2cc(OCc3ccc(COc4ccc(C(F)(F)F)cc4)cc3)ccc12
|
C25H19F3O4S 472.484000 |
AGRKTWIASZYTNW-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50213330; PubChem:CID44432403
|
Local ready
Direct docking supported
|
|
E3L048644
BDB048644
|
BDBM50213331
Cc1nc(C(F)(F)F)sc1CSc1ccc2c(ccn2CC(=O)O)c1
|
C16H13F3N2O2S2 386.420000 |
SBRYXHXGTIWXKI-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50213331; PubChem:CID44432411
|
Local ready
Direct docking supported
|
|
E3L048645
BDB048645
|
BDBM50213332
O=C(O)Cc1csc2cc(OCc3cc(-c4ccc(Cl)cc4)on3)cc(Cl)c12
|
C20H13Cl2NO4S 434.300000 |
YKBNKZOCKAZLRU-UHFFFAOYSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50213332; PubChem:CID22504797
|
Local ready
Direct docking supported
|
|
E3L048646
BDB048646
|
BDBM50213333
O=C(O)Cc1coc2cc(OCc3ccc(COc4ccc(C(F)(F)F)cc4)cc3)ccc12
|
C25H19F3O5 456.416000 |
ZJLARBDRTDXSIO-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50213333; PubChem:CID44432406
|
Local ready
Direct docking supported
|
|
E3L048647
BDB048647
|
BDBM50213334
O=C(O)Cc1coc2cc(OCc3cc(-c4ccc(Cl)cc4)on3)ccc12
|
C20H14ClNO5 383.787000 |
USGOBGVRHPNUJT-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50213334; PubChem:CID22504857
|
Local ready
Direct docking supported
|
|
E3L048648
BDB048648
|
BDBM50213414
C[C@@H]1O[C@@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(=O)c-3c2O)[C@H](O)[C@H](O)[C@H]1O
|
C21H20O10 432.381000 |
ZWCVYHPDDFISLG-AEIZVZFYSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM50213414
|
Local ready
Direct docking supported
|
|
E3L048649
BDB048649
|
Seladelpar
CCO[C@H](COc1ccc(C(F)(F)F)cc1)CSc1ccc(OCC(=O)O)c(C)c1
|
C21H23F3O5S 444.471000 |
JWHYSEDOYMYMNM-QGZVFWFLSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50213714; PubChem:CID11236126
|
Local ready
Direct docking supported
|
|
E3L048650
BDB048650
|
BDBM50213768
O=C(O)CCc1ccc(OCCN(Cc2ccc(C(F)(F)F)cc2)c2nc3ccccc3s2)cc1
|
C26H23F3N2O3S 500.542000 |
HSSMYARAMDCPNL-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50213768; PubChem:CID44440929
|
Local ready
Direct docking supported
|
|
E3L048651
BDB048651
|
BDBM50213771
CC(C)(C)c1ccc(CN(CCOc2ccc(CCC(=O)O)cc2)c2nc3ccccc3s2)cc1
|
C29H32N2O3S 488.653000 |
FDQATLLJBRABRJ-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50213771; PubChem:CID44440928
|
Local ready
Direct docking supported
|
|
E3L048652
BDB048652
|
BDBM50214195
CCCOc1ccc(CC(CC)C(=O)O)cc1CNC(=O)c1ccc(C(F)(F)F)cc1F
|
C23H25F4NO4 455.448000 |
UGUQWKRCJKSPSZ-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50214195; PubChem:CID44424586
|
Local ready
Direct docking supported
|
|
E3L048653
BDB048653
|
BDBM50214196
CCC(Cc1ccc(OCc2ccccc2)c(CNC(=O)c2ccc(C(F)(F)F)cc2)c1)C(=O)O
|
C27H26F3NO4 485.502000 |
ADFJDYBYPYXLEP-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50214196; PubChem:CID44424584
|
Local ready
Direct docking supported
|
|
E3L048654
BDB048654
|
BDBM50214197
CCCC(Cc1ccc(OC)c(CNC(=O)c2ccc(C(F)(F)F)cc2)c1)C(=O)O
|
C22H24F3NO4 423.431000 |
BEXZWJKLLDXOCX-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50214197; PubChem:CID44424591
|
Local ready
Direct docking supported
|
|
E3L048655
BDB048655
|
BDBM50214198
CCCCCCOc1ccc(CC(CC)C(=O)O)cc1CNC(=O)c1ccc(C(F)(F)F)cc1
|
C26H32F3NO4 479.539000 |
HXLPZGNZHMZDIY-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50214198; PubChem:CID24890513
|
Local ready
Direct docking supported
|
|
E3L048656
BDB048656
|
BDBM50214199
CCCCC(Cc1ccc(OC)c(CNC(=O)c2ccc(C(F)(F)F)cc2F)c1)C(=O)O
|
C23H25F4NO4 455.448000 |
JSZKCNGJIUQQQN-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50214199; PubChem:CID44424594
|
Local ready
Direct docking supported
|
|
E3L048657
BDB048657
|
BDBM50214200
CCCCOc1ccc(CC(CCC)C(=O)O)cc1CNC(=O)c1ccc(C(F)(F)F)cc1F
|
C25H29F4NO4 483.502000 |
YFOSSOSPJLEQRP-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50214200; PubChem:CID44424595
|
Local ready
Direct docking supported
|
|
E3L048658
BDB048658
|
BDBM50214201
CCCCC(Cc1ccc(OC)c(CNC(=O)c2ccc(C(F)(F)F)cc2)c1)C(=O)O
|
C23H26F3NO4 437.458000 |
YKLQIFXBHVFFQC-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50214201; PubChem:CID44424592
|
Local ready
Direct docking supported
|
|
E3L048659
BDB048659
|
BDBM50214202
CCCCOc1ccc(CC(CC)C(=O)O)cc1CNC(=O)c1ccc(C(F)(F)F)cc1
|
C24H28F3NO4 451.485000 |
PGMNREGYAOBCRN-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50214202; PubChem:CID44424583
|
Local ready
Direct docking supported
|
|
E3L048660
BDB048660
|
BDBM50214203
CC[C@@H](Cc1ccc(OC)c(CNC(=O)c2ccc(C(F)(F)F)cc2F)c1)C(=O)O
|
C21H21F4NO4 427.394000 |
BDLLIPYDNFENMY-ZDUSSCGKSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50214203; PubChem:CID11711595
|
Local ready
Direct docking supported
|