| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L049581
BDB049581
|
BDBM50244362
COc1ccccc1S(=O)(=O)n1c(CCCC(=O)O)cc2cc(C(F)(F)F)ccc21
|
C20H18F3NO5S 441.427000 |
VUFONJZIUVKUQA-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50244362; PubChem:CID137643489
|
Local ready
Direct docking supported
|
|
E3L049582
BDB049582
|
BDBM50244363
O=C(O)CCCc1cc2cc(C(F)(F)F)ccc2n1S(=O)(=O)c1ccccc1Cl
|
C19H15ClF3NO4S 445.846000 |
KHGKAKHTWJIELW-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50244363; PubChem:CID137644269
|
Local ready
Direct docking supported
|
|
E3L049583
BDB049583
|
BDBM50244364
O=C(O)CCCc1cc2cc(C(F)(F)F)ccc2n1S(=O)(=O)c1cccc(OC(F)(F)F)c1
|
C20H15F6NO5S 495.397000 |
FZGVEBXBKIDUTK-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50244364; PubChem:CID137639724
|
Local ready
Direct docking supported
|
|
E3L049584
BDB049584
|
BDBM50244392
COc1ccc(S(=O)(=O)n2c(CCCC(=O)O)cc3cc(Cl)ccc32)cc1
|
C19H18ClNO5S 407.875000 |
QVYDDFGTHKLMGX-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50244392; PubChem:CID68676633
|
Local ready
Direct docking supported
|
|
E3L049585
BDB049585
|
BDBM50244393
Cc1ccc(S(=O)(=O)n2c(CCCC(=O)O)cc3cc(Cl)ccc32)cc1
|
C19H18ClNO4S 391.876000 |
FLFDQPVCPTUSNL-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50244393; PubChem:CID137654739
|
Local ready
Direct docking supported
|
|
E3L049586
BDB049586
|
BDBM50244394
O=C(O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1cccc2ccccc12
|
C22H18ClNO4S 427.909000 |
LLMJACNFUBKGBO-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50244394; PubChem:CID68676761
|
Local ready
Direct docking supported
|
|
E3L049587
BDB049587
|
BDBM50244395
Cc1nc2ccc(S(=O)(=O)n3c(CCCC(=O)O)cc4cc(Cl)ccc43)cc2s1
|
C20H17ClN2O4S2 448.953000 |
IDHGWDJLPAEGIQ-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50244395; PubChem:CID16048150
|
Local ready
Direct docking supported
|
|
E3L049588
BDB049588
|
BDBM50244396
Cc1nc2cc(S(=O)(=O)n3c(CCCC(=O)O)cc4cc(Cl)ccc43)ccc2s1
|
C20H17ClN2O4S2 448.953000 |
ZHIXNPKWUNYGDX-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50244396; PubChem:CID68676782
|
Local ready
Direct docking supported
|
|
E3L049589
BDB049589
|
BDBM50244397
Nc1nc2ccc(S(=O)(=O)n3c(CCCC(=O)O)cc4cc(Cl)ccc43)cc2s1
|
C19H16ClN3O4S2 449.941000 |
QSZIECXNQDNMNC-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50244397; PubChem:CID87537807
|
Local ready
Direct docking supported
|
|
E3L049590
BDB049590
|
BDBM50244420
Nc1nc2ccc(S(=O)(=O)n3c(CCCC(=O)O)cc4cc(Cl)ccc43)cc2o1
|
C19H16ClN3O5S 433.873000 |
GNVBVBBILCLWPZ-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50244420; PubChem:CID68676459
|
Local ready
Direct docking supported
|
|
E3L049591
BDB049591
|
BDBM50244426
O=C(O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2nsnc2c1
|
C18H14ClN3O4S2 435.914000 |
GZYCZPILQMFQLH-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50244426; PubChem:CID68676158
|
Local ready
Direct docking supported
|
|
E3L049592
BDB049592
|
BDBM50244427
O=C(O)CCCc1cc2cc(C(F)(F)F)ccc2n1S(=O)(=O)c1ccc2scnc2c1
|
C20H15F3N2O4S2 468.478000 |
WGTAUAZHQSPFJL-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50244427; PubChem:CID137633219
|
Local ready
Direct docking supported
|
|
E3L049593
BDB049593
|
BDBM50244428
O=C(O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2nc[nH]c2c1
|
C19H16ClN3O4S 417.874000 |
CYHLTYJBLZQCBF-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50244428; PubChem:CID68677705
|
Local ready
Direct docking supported
|
|
E3L049594
BDB049594
|
BDBM50244429
COc1ccc(S(=O)(=O)n2c(CCCC(=O)O)cc3cc(C(F)(F)F)ccc32)cc1
|
C20H18F3NO5S 441.427000 |
SKLCLUUFJZJTHV-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50244429; PubChem:CID137637955
|
Local ready
Direct docking supported
|
|
E3L049595
BDB049595
|
BDBM50244431
O=C(O)CCCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccc2ccccc2c1
|
C22H18ClNO4S 427.909000 |
AWLRKHVXMRLDGU-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50244431; PubChem:CID68676826
|
Local ready
Direct docking supported
|
|
E3L049596
BDB049596
|
BDBM50244432
CC(C)(CCc1cc2cc(Cl)ccc2n1S(=O)(=O)c1ccccc1)C(=O)O
|
C20H20ClNO4S 405.903000 |
FMZHGKSOZMYBLL-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50244432; PubChem:CID68675602
|
Local ready
Direct docking supported
|
|
E3L049597
BDB049597
|
BDBM50244556
Cc1c(C(=O)c2ccc(Cl)cc2)c2ccc(OC(F)(F)F)cc2n1Cc1cccc(O[C@@H](C)C(=O)O)c1
|
C27H21ClF3NO5 531.914000 |
DHUATBAZHILHIC-INIZCTEOSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50244556; PubChem:CID44190592
|
Local ready
Direct docking supported
|
|
E3L049598
BDB049598
|
BDBM50244557
COc1ccc(C(=O)c2c(C)n(Cc3cccc(O[C@H](C)C(=O)O)c3)c3ncccc23)cc1
|
C26H24N2O5 444.487000 |
OMBSMQLLFJMMRZ-QGZVFWFLSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50244557; PubChem:CID44561770
|
Local ready
Direct docking supported
|
|
E3L049599
BDB049599
|
BDBM50244608
COc1ccc(C(=O)c2c(C)n(Cc3cccc(O[C@@H](C)C(=O)O)c3)c3ncccc23)cc1
|
C26H24N2O5 444.487000 |
OMBSMQLLFJMMRZ-KRWDZBQOSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50244608; PubChem:CID44561816
|
Local ready
Direct docking supported
|
|
E3L049600
BDB049600
|
BDBM50244609
COc1ccc(C(=O)c2c(C)n(Cc3cc(O[C@@H](C)C(=O)O)ccc3F)c3ncccc23)cc1
|
C26H23FN2O5 462.477000 |
GOUUJVYUPXBGJV-INIZCTEOSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50244609; PubChem:CID25211572
|
Local ready
Direct docking supported
|