| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L047041
BDB047041
|
BDBM50157916
COc1ccc2c(c1)c(Cc1cccc(OC(C)(C)C(=O)O)c1)c(C)n2C(=O)c1ccc(Cl)cc1
|
C28H26ClNO5 491.971000 |
NJQKVYQTUIWJEQ-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50157916; PubChem:CID10228304
|
Local ready
Direct docking supported
|
|
E3L047042
BDB047042
|
Mrl24
COc1ccc(C(=O)n2c(C)c(Cc3cccc(O[C@@H](C)C(=O)O)c3)c3cc(OC(F)(F)F)ccc32)cc1
|
C28H24F3NO6 527.495000 |
OFCWBJAYEIROGZ-KRWDZBQOSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50157917; PubChem:CID9958543
|
Local ready
Direct docking supported
|
|
E3L047043
BDB047043
|
BDBM50157918
COc1ccc2c(c1)c(Cc1ccccc1OC(C)(C)C(=O)O)c(C)n2C(=O)c1ccc(Cl)cc1
|
C28H26ClNO5 491.971000 |
HIPJZUFYVANNKA-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50157918; PubChem:CID10184971
|
Local ready
Direct docking supported
|
|
E3L047044
BDB047044
|
BDBM50157919
CCC(Oc1ccccc1Cc1c(C)n(C(=O)c2ccc(OC)cc2)c2ccc(OC(F)(F)F)cc12)C(=O)O
|
C29H26F3NO6 541.522000 |
CHGUIFODGMMMKV-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50157919; PubChem:CID44388998
|
Local ready
Direct docking supported
|
|
E3L047045
BDB047045
|
BDBM50157920
COc1ccc(C(=O)n2c(C)c(Cc3cccc(OC(C)(C)C(=O)O)c3)c3cc(OC(F)(F)F)ccc32)cc1
|
C29H26F3NO6 541.522000 |
WTIUDROYDYCRCV-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50157920; PubChem:CID10280496
|
Local ready
Direct docking supported
|
|
E3L047046
BDB047046
|
BDBM50157921
CCCC(Oc1cccc(Cc2c(C)n(C(=O)c3ccc(OC)cc3)c3ccc(OC(F)(F)F)cc23)c1)C(=O)O
|
C30H28F3NO6 555.549000 |
UNNWWBCMUJHNAH-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50157921; PubChem:CID44389098
|
Local ready
Direct docking supported
|
|
E3L047047
BDB047047
|
BDBM50157922
COc1ccc2c(c1)c(Cc1cccc(OCC(=O)O)c1)c(C)n2C(=O)c1ccc(Cl)cc1
|
C26H22ClNO5 463.917000 |
CZMXEBXOLTWIEN-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50157922; PubChem:CID10183245
|
Local ready
Direct docking supported
|
|
E3L047048
BDB047048
|
BDBM50157923
COc1ccc2c(c1)c(Cc1ccc(OC(C)(C)C(=O)O)cc1)c(C)n2C(=O)c1ccc(Cl)cc1
|
C28H26ClNO5 491.971000 |
GWYAJCNLNHXXBS-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50157923; PubChem:CID10141294
|
Local ready
Direct docking supported
|
|
E3L047049
BDB047049
|
BDBM50157924
COc1ccc2c(c1)c(Cc1ccccc1OCC(=O)O)c(C)n2C(=O)c1ccc(Cl)cc1
|
C26H22ClNO5 463.917000 |
ADWNMHCJSZMYGA-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50157924; PubChem:CID10205060
|
Local ready
Direct docking supported
|
|
E3L047050
BDB047050
|
BDBM50157925
CCC(Oc1cccc(Cc2c(C)n(C(=O)c3ccc(OC)cc3)c3ccc(OC(F)(F)F)cc23)c1)C(=O)O
|
C29H26F3NO6 541.522000 |
XTHHGKZVXMNJNA-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50157925; PubChem:CID44389085
|
Local ready
Direct docking supported
|
|
E3L047051
BDB047051
|
Mrl24
COc1ccc(C(=O)n2c(C)c(Cc3cccc(O[C@@H](C)C(=O)O)c3)c3cc(OC(F)(F)F)ccc32)cc1
|
C28H24F3NO6 527.495000 |
OFCWBJAYEIROGZ-KRWDZBQOSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50157926; PubChem:CID9958543
|
Local ready
Direct docking supported
|
|
E3L047052
BDB047052
|
BDBM50157927
COc1ccc(C(=O)n2c(C)c(Cc3cccc(O[C@H](C)C(=O)O)c3)c3cc(OC(F)(F)F)ccc32)cc1
|
C28H24F3NO6 527.495000 |
OFCWBJAYEIROGZ-QGZVFWFLSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50157927; PubChem:CID44388966
|
Local ready
Direct docking supported
|
|
E3L047053
BDB047053
|
BDBM50157928
COc1ccc2c(c1)c(Cc1ccccc1C(=O)O)c(C)n2C(=O)c1ccc(Cl)cc1
|
C25H20ClNO4 433.891000 |
RSIJFBWODLEWFF-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50157928; PubChem:CID44391841
|
Local ready
Direct docking supported
|
|
E3L047054
BDB047054
|
BDBM50157929
COc1ccc2c(c1)c(Cc1cccc(C(=O)O)c1)c(C)n2C(=O)c1ccc(Cl)cc1
|
C25H20ClNO4 433.891000 |
XPUQBKVFRAHDME-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50157929; PubChem:CID44389035
|
Local ready
Direct docking supported
|
|
E3L047055
BDB047055
|
BDBM50157930
COc1ccc2c(c1)c(Cc1ccccc1OC(C)C(=O)O)c(C)n2C(=O)c1ccc(Cl)cc1
|
C27H24ClNO5 477.944000 |
XICCHOADKSBRIM-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50157930; PubChem:CID10277333
|
Local ready
Direct docking supported
|
|
E3L047056
BDB047056
|
BDBM50157931
COc1ccc(C(=O)n2c(C)c(Cc3ccccc3OC(C)(C)C(=O)O)c3cc(OC(F)(F)F)ccc32)cc1
|
C29H26F3NO6 541.522000 |
SGUDWIZALUVLKT-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50157931; PubChem:CID10230642
|
Local ready
Direct docking supported
|
|
E3L047057
BDB047057
|
BDBM50157932
COc1ccc(C(=O)n2c(C)c(Cc3ccccc3O[C@H](C)C(=O)O)c3cc(OC(F)(F)F)ccc32)cc1
|
C28H24F3NO6 527.495000 |
BWTOBMCYVACNJZ-QGZVFWFLSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50157932; PubChem:CID10119125
|
Local ready
Direct docking supported
|
|
E3L047058
BDB047058
|
Mrl20
COc1ccc(C(=O)n2c(C)c(Cc3ccccc3O[C@@H](C)C(=O)O)c3cc(OC(F)(F)F)ccc32)cc1
|
C28H24F3NO6 527.495000 |
BWTOBMCYVACNJZ-KRWDZBQOSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50157933; PubChem:CID10143056
|
Local ready
Direct docking supported
|
|
E3L047059
BDB047059
|
BDBM50157934
COc1ccc2c(c1)c(Cc1cccc(OC(C)C(=O)O)c1)c(C)n2C(=O)c1ccc(Cl)cc1
|
C27H24ClNO5 477.944000 |
UZJIHIMYKLEBBQ-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50157934; PubChem:CID10184159
|
Local ready
Direct docking supported
|
|
E3L047060
BDB047060
|
BDBM50157935
COc1ccc2c(c1)c(Cc1ccc(C(=O)O)cc1)c(C)n2C(=O)c1ccc(Cl)cc1
|
C25H20ClNO4 433.891000 |
AWSRKKKMZUGBQJ-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50157935; PubChem:CID44388945
|
Local ready
Direct docking supported
|