| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L048621
BDB048621
|
BDBM50213191
CCO[C@@H](Cc1ccc(CCCOC(=S)NCc2ccccc2)cc1)C(=O)O
|
C22H27NO4S 401.528000 |
USPTZSXVIKAREO-FQEVSTJZSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50213191; PubChem:CID44431886
|
Local ready
Direct docking supported
|
|
E3L048622
BDB048622
|
BDBM50213309
Cc1cc(OCc2cc(-c3ccc(Cl)cc3)on2)cc2scc(CC(=O)O)c12
|
C21H16ClNO4S 413.882000 |
GTZMHMRAOJUYKJ-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50213309; PubChem:CID22504917
|
Local ready
Direct docking supported
|
|
E3L048623
BDB048623
|
BDBM50213310
Cc1cc2c(CC(=O)O)csc2cc1OCc1ccccc1COc1ccc(C(F)(F)F)cc1
|
C26H21F3O4S 486.511000 |
YDNAXUMKGRAZTP-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50213310; PubChem:CID44432401
|
Local ready
Direct docking supported
|
|
E3L048624
BDB048624
|
BDBM50213311
O=C(O)Cc1csc2cc(OCc3cccc(COc4ccc(C(F)(F)F)cc4)c3)ccc12
|
C25H19F3O4S 472.484000 |
PSCZHGLGZAJATA-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50213311; PubChem:CID44432402
|
Local ready
Direct docking supported
|
|
E3L048625
BDB048625
|
BDBM50213312
O=C(O)Cc1csc2cc(OCc3cc(-c4ccc(C(F)(F)F)cc4)on3)cc(Cl)c12
|
C21H13ClF3NO4S 467.852000 |
NYCOHPNFMJTKMD-UHFFFAOYSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50213312; PubChem:CID22504835
|
Local ready
Direct docking supported
|
|
E3L048626
BDB048626
|
BDBM50213313
Cc1nc(C(F)(F)F)sc1COc1ccc2c(ccn2CC(=O)O)c1
|
C16H13F3N2O3S 370.352000 |
PYEXAJOHIMHJGE-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50213313; PubChem:CID44432407
|
Local ready
Direct docking supported
|
|
E3L048627
BDB048627
|
BDBM50213314
O=C(O)Cc1csc2cc(OCc3ccccc3COc3ccc(C(F)(F)F)cc3)ccc12
|
C25H19F3O4S 472.484000 |
JXINCKMDJNKMBL-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50213314; PubChem:CID44432400
|
Local ready
Direct docking supported
|
|
E3L048628
BDB048628
|
BDBM50213315
O=C(O)Cc1csc2cc(OCc3cc(-c4ccc(C(F)(F)F)cc4)on3)ccc12
|
C21H14F3NO4S 433.407000 |
JBPZDKKCFFLXRS-UHFFFAOYSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50213315; PubChem:CID11327951
|
Local ready
Direct docking supported
|
|
E3L048629
BDB048629
|
BDBM50213316
O=C(O)Cn1ccc2cc(OCc3cccc(COc4ccc(C(F)(F)F)cc4)c3)ccc21
|
C25H20F3NO4 455.432000 |
HPRZJTYQTBHRKL-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50213316; PubChem:CID44432409
|
Local ready
Direct docking supported
|
|
E3L048630
BDB048630
|
BDBM50213317
O=C(O)Cc1coc2cc(OCc3cccc(COc4ccc(C(F)(F)F)cc4)c3)ccc12
|
C25H19F3O5 456.416000 |
WUEITGSPHUOFIP-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50213317; PubChem:CID44432405
|
Local ready
Direct docking supported
|
|
E3L048631
BDB048631
|
BDBM50213318
Cc1cc2c(CC(=O)O)csc2cc1OCc1cc(-c2ccc(Cl)cc2)on1
|
C21H16ClNO4S 413.882000 |
ZVKBDHBUPHRNRS-UHFFFAOYSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50213318; PubChem:CID22504843
|
Local ready
Direct docking supported
|
|
E3L048632
BDB048632
|
BDBM50213319
O=C(O)Cn1ccc2cc(OCc3ccccc3COc3ccc(C(F)(F)F)cc3)ccc21
|
C25H20F3NO4 455.432000 |
YAJRCQJLKBPIDO-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50213319; PubChem:CID44432408
|
Local ready
Direct docking supported
|
|
E3L048633
BDB048633
|
BDBM50213320
O=C(O)Cn1ccc2cc(OCc3cc(-c4ccc(C(F)(F)F)cc4)on3)ccc21
|
C21H15F3N2O4 416.355000 |
GPOKBAQNQTXHEM-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50213320; PubChem:CID22504766
|
Local ready
Direct docking supported
|
|
E3L048634
BDB048634
|
BDBM50213321
O=C(O)Cc1csc2cc(OCc3cc(-c4ccc(Cl)cc4)on3)ccc12
|
C20H14ClNO4S 399.855000 |
ISEMTHSDRXTHAL-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50213321; PubChem:CID11188766
|
Local ready
Direct docking supported
|
|
E3L048635
BDB048635
|
BDBM50213322
Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1COc1cc(Cl)c2c(CC(=O)O)csc2c1
|
C22H15ClF3NO3S2 497.947000 |
KQXRKZBFMUIPSS-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50213322; PubChem:CID44432399
|
Local ready
Direct docking supported
|
|
E3L048636
BDB048636
|
BDBM50213323
O=C(O)Cn1ccc2cc(OCc3ccc(Oc4ccc(C(F)(F)F)cc4)cc3)ccc21
|
C24H18F3NO4 441.405000 |
ZDAMGGKWEUMTPY-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50213323; PubChem:CID44432410
|
Local ready
Direct docking supported
|
|
E3L048637
BDB048637
|
BDBM50213324
Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1COc1ccc2c(CC(=O)O)coc2c1
|
C22H16F3NO4S 447.434000 |
MKYMMWPWWXRSRX-UHFFFAOYSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50213324; PubChem:CID44432395
|
Local ready
Direct docking supported
|
|
E3L048638
BDB048638
|
BDBM50213325
O=C(O)Cc1coc2cc(OCc3cc(-c4ccc(C(F)(F)F)cc4)on3)ccc12
|
C21H14F3NO5 417.339000 |
ABYFOELKELEOKM-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50213325; PubChem:CID22504899
|
Local ready
Direct docking supported
|
|
E3L048639
BDB048639
|
BDBM50213326
Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1COc1ccc2c(CC(=O)O)csc2c1
|
C22H16F3NO3S2 463.502000 |
OWQMSVAYBUHJBB-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50213326; PubChem:CID10217191
|
Local ready
Direct docking supported
|
|
E3L048640
BDB048640
|
BDBM50213327
O=C(O)Cc1coc2cc(OCc3ccccc3COc3ccc(C(F)(F)F)cc3)ccc12
|
C25H19F3O5 456.416000 |
VCBLIAOVKZSFHN-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50213327; PubChem:CID44432404
|
Local ready
Direct docking supported
|