| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L051361
BDB051361
|
2-(4-(3-Phenoxypropoxy)-phenylthio)hexanoic acid
CCCCC(Sc1ccc(OCCCOc2ccccc2)cc1)C(=O)O
|
C21H26O4S 374.502000 |
MHFJMHMWBKXGQA-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50297873; PubChem:CID45271974
|
Local ready
Direct docking supported
|
|
E3L051362
BDB051362
|
2-(4-(3-(o-Tolyloxy)propoxy)phenylthio)hexanoic acid
CCCCC(Sc1ccc(OCCCOc2ccccc2C)cc1)C(=O)O
|
C22H28O4S 388.529000 |
HPYUXOQIJPMIGD-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50297874; PubChem:CID45271983
|
Local ready
Direct docking supported
|
|
E3L051363
BDB051363
|
2-(4-(3-(m-Tolyloxy)propoxy)phenylthio)hexanoic acid
CCCCC(Sc1ccc(OCCCOc2cccc(C)c2)cc1)C(=O)O
|
C22H28O4S 388.529000 |
RVWOTZLCSHAAGT-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50297875; PubChem:CID45267718
|
Local ready
Direct docking supported
|
|
E3L051364
BDB051364
|
2-(4-(3-(p-Tolyloxy)propoxy)phenylthio)hexanoic acid
CCCCC(Sc1ccc(OCCCOc2ccc(C)cc2)cc1)C(=O)O
|
C22H28O4S 388.529000 |
WMMXNIPBRIKWTB-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50297876; PubChem:CID45272810
|
Local ready
Direct docking supported
|
|
E3L051365
BDB051365
|
BDBM50297877
CCCCC(Sc1ccc(OCCCOc2ccc(C)c(C)c2)cc1)C(=O)O
|
C23H30O4S 402.556000 |
WEKKXRVUIMLCSV-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50297877; PubChem:CID44249904
|
Local ready
Direct docking supported
|
|
E3L051366
BDB051366
|
BDBM50297878
CCCCC(Sc1ccc(OCCCOc2cccc(C)c2C)cc1)C(=O)O
|
C23H30O4S 402.556000 |
SPSCEYHKPUTWNP-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50297878; PubChem:CID45273770
|
Local ready
Direct docking supported
|
|
E3L051367
BDB051367
|
BDBM50297879
CCCC[C@@H](Sc1ccc(OCCCOc2cccc(C)c2C)cc1)C(=O)O
|
C23H30O4S 402.556000 |
SPSCEYHKPUTWNP-JOCHJYFZSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50297879; PubChem:CID44249905
|
Local ready
Direct docking supported
|
|
E3L051368
BDB051368
|
BDBM50297880
CCCC[C@H](Sc1ccc(OCCCOc2cccc(C)c2C)cc1)C(=O)O
|
C23H30O4S 402.556000 |
SPSCEYHKPUTWNP-QFIPXVFZSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50297880; PubChem:CID45271105
|
Local ready
Direct docking supported
|
|
E3L051369
BDB051369
|
BDBM50297881
CCCCC(Sc1ccc(OCCCOc2cccc3c2CCCC3)cc1)C(=O)O
|
C25H32O4S 428.594000 |
LUTLDXKHISCIJB-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50297881; PubChem:CID45272820
|
Local ready
Direct docking supported
|
|
E3L051370
BDB051370
|
BDBM50297882
CCCCC(Sc1ccc(OCCCOc2ccccc2OC)cc1)C(=O)O
|
C22H28O5S 404.528000 |
ITSGBPFMQAYNSO-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50297882; PubChem:CID45269442
|
Local ready
Direct docking supported
|
|
E3L051371
BDB051371
|
BDBM50297883
CCCCC(Sc1ccc(OCCCOc2cccc(OC)c2)cc1)C(=O)O
|
C22H28O5S 404.528000 |
UKCHEONEJZMTLM-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50297883; PubChem:CID45271992
|
Local ready
Direct docking supported
|
|
E3L051372
BDB051372
|
BDBM50297884
CCCCC(Sc1ccc(OCCCOc2ccccc2C(C)C)cc1)C(=O)O
|
C24H32O4S 416.583000 |
ITNPHPQZKZCHCC-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50297884; PubChem:CID45267726
|
Local ready
Direct docking supported
|
|
E3L051373
BDB051373
|
BDBM50297885
CCCCC(Sc1ccc(OCCCOc2cccc(C(C)C)c2)cc1)C(=O)O
|
C24H32O4S 416.583000 |
CUSRKEXXWGILRX-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50297885; PubChem:CID45270286
|
Local ready
Direct docking supported
|
|
E3L051374
BDB051374
|
BDBM50297886
CCCCC(Sc1ccc(OCCCOc2cccc(C(F)(F)F)c2)cc1)C(=O)O
|
C22H25F3O4S 442.499000 |
JZYMMZPAPFPFPX-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50297886; PubChem:CID45268597
|
Local ready
Direct docking supported
|
|
E3L051375
BDB051375
|
BDBM50297887
CCCCC(Sc1ccc(OCCCOc2ccc(Cl)c(C(F)(F)F)c2)cc1)C(=O)O
|
C22H24ClF3O4S 476.944000 |
ASHJFOIBKHRPEA-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50297887; PubChem:CID45271112
|
Local ready
Direct docking supported
|
|
E3L051376
BDB051376
|
BDBM50297888
CCCCC(Sc1ccc(OCCCOc2ccc(-c3ccccc3)cc2)cc1)C(=O)O
|
C27H30O4S 450.600000 |
PMSKZXYPUKICSQ-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50297888; PubChem:CID45269452
|
Local ready
Direct docking supported
|
|
E3L051377
BDB051377
|
BDBM50297889
CCCCC(Sc1ccc(OCCCOc2ccc3ncccc3c2)cc1)C(=O)O
|
C24H27NO4S 425.550000 |
NBVFRRBGSXLXMI-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50297889; PubChem:CID45270291
|
Local ready
Direct docking supported
|
|
E3L051378
BDB051378
|
BDBM50297890
Cc1cccc(OCCCOc2ccc(SCC(=O)O)cc2)c1C
|
C19H22O4S 346.448000 |
JEALQGSCFFCFEN-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50297890; PubChem:CID45273780
|
Local ready
Direct docking supported
|
|
E3L051379
BDB051379
|
BDBM50297891
Cc1cccc(OCCCOc2ccc(CCC(=O)O)cc2)c1C
|
C20H24O4 328.408000 |
KEYKHKKAFOXBBL-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50297891; PubChem:CID45269453
|
Local ready
Direct docking supported
|
|
E3L051380
BDB051380
|
BDBM50297892
CCCCC(Cc1ccc(OCCCOc2cccc(C)c2C)cc1)C(=O)O
|
C24H32O4 384.516000 |
LRVSQBHZOPHQKT-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50297892; PubChem:CID45268611
|
Local ready
Direct docking supported
|