| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L056741
BDB056741
|
BDBM50450134
Cn1c(COc2cccc(C(=O)O)c2)nc2ccc(Oc3ncc(Cl)cc3Cl)cc21
|
C21H15Cl2N3O4 444.274000 |
CFGZHSZSHNMRQR-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50450134; PubChem:CID46908817
|
Local ready
Direct docking supported
|
|
E3L056742
BDB056742
|
BDBM50450135
Cn1c(COc2cccc(C(=O)O)c2)nc2ccc(Oc3ncc(Cl)cc3F)cc21
|
C21H15ClFN3O4 427.819000 |
WXUQREAZTHUSGZ-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50450135; PubChem:CID46908815
|
Local ready
Direct docking supported
|
|
E3L056743
BDB056743
|
BDBM50450136
Cc1cc(Cl)cnc1Oc1ccc2nc(COc3cccc(C(=O)O)c3)n(C)c2c1
|
C22H18ClN3O4 423.856000 |
IKCVBZAEUMBBHZ-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50450136; PubChem:CID46908816
|
Local ready
Direct docking supported
|
|
E3L056744
BDB056744
|
BDBM50450137
Cn1c(COc2cccc(C(=O)O)c2)nc2ccc(Oc3cccc(Cl)n3)cc21
|
C21H16ClN3O4 409.829000 |
YWSJFUQEEQUFAT-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50450137; PubChem:CID145955603
|
Local ready
Direct docking supported
|
|
E3L056745
BDB056745
|
BDBM50450138
Cn1c(COc2cccc(C(=O)O)c2)nc2cnc(Oc3ccc4c(c3)OCC4)cc21
|
C23H19N3O5 417.421000 |
HGLUSLQAEOTCFZ-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50450138; PubChem:CID145951689
|
Local ready
Direct docking supported
|
|
E3L056746
BDB056746
|
BDBM50450139
Cn1c(COc2cccc(C(=O)O)c2)nc2ccc(Oc3ccc4c(c3)CCC4)nc21
|
C24H21N3O4 415.449000 |
ZNQAYBXPYCPXSY-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50450139; PubChem:CID145957036
|
Local ready
Direct docking supported
|
|
E3L056747
BDB056747
|
BDBM50450207
Cn1c(COc2cccc(C(=O)O)c2)nc2ccc(Oc3cccc(F)c3)cc21
|
C22H17FN2O4 392.386000 |
DNXGARQZYYYGKE-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50450207; PubChem:CID25115278
|
Local ready
Direct docking supported
|
|
E3L056748
BDB056748
|
BDBM50450208
Cn1c(COc2cccc(C(=O)O)c2)nc2ccc(Oc3ccc(F)cc3F)cc21
|
C22H16F2N2O4 410.376000 |
JSADKAUCLOIJDV-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50450208; PubChem:CID68662059
|
Local ready
Direct docking supported
|
|
E3L056749
BDB056749
|
BDBM50450209
COc1cccc(Oc2ccc3nc(COc4cccc(C(=O)O)c4)n(C)c3c2)c1
|
C23H20N2O5 404.422000 |
SMTOFNPJCJQJKP-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50450209; PubChem:CID68661491
|
Local ready
Direct docking supported
|
|
E3L056750
BDB056750
|
BDBM50450210
Cc1ccc(Oc2ccc3nc(COc4cccc(C(=O)O)c4)n(C)c3c2)cc1
|
C23H20N2O4 388.423000 |
IONMUFZKIJOLDZ-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50450210; PubChem:CID25115507
|
Local ready
Direct docking supported
|
|
E3L056751
BDB056751
|
BDBM50450211
Cc1ccc(Oc2ccc3nc(COc4cccc(C(=O)O)c4)n(C)c3c2)c(F)c1
|
C23H19FN2O4 406.413000 |
HLRCLDCEJSPCMJ-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50450211; PubChem:CID68661565
|
Local ready
Direct docking supported
|
|
E3L056752
BDB056752
|
BDBM50450212
Cc1ccc(F)cc1Oc1ccc2nc(COc3cccc(C(=O)O)c3)n(C)c2c1
|
C23H19FN2O4 406.413000 |
KINIHRBFPICAII-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50450212; PubChem:CID68661602
|
Local ready
Direct docking supported
|
|
E3L056753
BDB056753
|
BDBM50450213
Cc1cc(F)ccc1Oc1ccc2nc(COc3cccc(C(=O)O)c3)n(C)c2c1
|
C23H19FN2O4 406.413000 |
QKIAJKOHCOBJQP-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50450213; PubChem:CID68662065
|
Local ready
Direct docking supported
|
|
E3L056754
BDB056754
|
BDBM50450214
Cn1c(COc2cccc(C(=O)O)c2)nc2ccc(Oc3cc(F)cc(F)c3)cc21
|
C22H16F2N2O4 410.376000 |
JCIZDQAIDHYWAT-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50450214; PubChem:CID68661534
|
Local ready
Direct docking supported
|
|
E3L056755
BDB056755
|
BDBM50450215
Cn1c(COc2cccc(C(=O)O)c2)nc2ccc(Oc3ccc(F)c(F)c3)cc21
|
C22H16F2N2O4 410.376000 |
POVUPJXKVTVHPK-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50450215; PubChem:CID68662147
|
Local ready
Direct docking supported
|
|
E3L056756
BDB056756
|
BDBM50450216
Cn1c(COc2cccc(C(=O)O)c2)nc2ccc(Oc3c(F)cccc3F)cc21
|
C22H16F2N2O4 410.376000 |
KAUVDIYMCDKFHD-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50450216; PubChem:CID145972429
|
Local ready
Direct docking supported
|
|
E3L056757
BDB056757
|
BDBM50450217
Cn1c(COc2cccc(C(=O)O)c2)nc2ccc(Oc3cc(F)ccc3F)cc21
|
C22H16F2N2O4 410.376000 |
UDONKWVUKRXGRH-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50450217; PubChem:CID25115277
|
Local ready
Direct docking supported
|
|
E3L056758
BDB056758
|
BDBM50450218
Cn1c(COc2cccc(C(=O)O)c2)nc2ccc(Oc3cccc(OC(F)(F)F)c3)cc21
|
C23H17F3N2O5 458.392000 |
ZKTOXNZNHAZRCB-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50450218; PubChem:CID68661793
|
Local ready
Direct docking supported
|
|
E3L056759
BDB056759
|
BDBM50450219
CCOc1cccc(Oc2ccc3nc(COc4cccc(C(=O)O)c4)n(C)c3c2)c1
|
C24H22N2O5 418.449000 |
AXIJPLLWCGCPLO-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50450219; PubChem:CID145955653
|
Local ready
Direct docking supported
|
|
E3L056760
BDB056760
|
BDBM50450220
COc1ccc(Oc2ccc3nc(COc4cccc(C(=O)O)c4)n(C)c3c2)cc1
|
C23H20N2O5 404.422000 |
FDORYMUQVHPYCD-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50450220; PubChem:CID68661324
|
Local ready
Direct docking supported
|