| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L060081
BDB060081
|
BDBM50545886
COc1cc(Oc2ccc3nc(COc4cccc(C(=O)O)c4)n(C)c3c2)cc(C)n1
|
C23H21N3O5 419.437000 |
DKPNINZWBNWHCX-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50545886; PubChem:CID46909008
|
Local ready
Direct docking supported
|
|
E3L060082
BDB060082
|
BDBM50545887
COc1cc(Oc2ccc3nc(COc4cccc(C(=O)O)c4)n(C)c3n2)cc(C)n1
|
C22H20N4O5 420.425000 |
YXSAVKVZVZAQQT-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50545887; PubChem:CID162661673
|
Local ready
Direct docking supported
|
|
E3L060083
BDB060083
|
BDBM50545888
Cc1ccc(Oc2cc(C)c3nc(COc4cccc(C(=O)O)c4)n(C)c3c2)c(C)n1
|
C24H23N3O4 417.465000 |
UILRJZSMSDGETI-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50545888; PubChem:CID162651393
|
Local ready
Direct docking supported
|
|
E3L060084
BDB060084
|
BDBM50545889
COc1cc(Oc2ccc(C)nc2C)cc2c1nc(COc1cccc(C(=O)O)c1)n2C
|
C24H23N3O5 433.464000 |
QPMHENJVTMRJDO-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50545889; PubChem:CID162668897
|
Local ready
Direct docking supported
|
|
E3L060085
BDB060085
|
BDBM50545890
CCOc1cc(Oc2ccc(C)nc2C)cc2c1nc(COc1cccc(C(=O)O)c1)n2C
|
C25H25N3O5 447.491000 |
LPOGJMBYZMVYQC-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50545890; PubChem:CID162651411
|
Local ready
Direct docking supported
|
|
E3L060086
BDB060086
|
BDBM50545891
CCCOc1cc(Oc2ccc(C)nc2C)cc2c1nc(COc1cccc(C(=O)O)c1)n2C
|
C26H27N3O5 461.518000 |
RZDIFGAERNRCIQ-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50545891; PubChem:CID162661270
|
Local ready
Direct docking supported
|
|
E3L060087
BDB060087
|
BDBM50545892
Cc1ccc(Oc2cc(OC(C)C)c3nc(COc4cccc(C(=O)O)c4)n(C)c3c2)c(C)n1
|
C26H27N3O5 461.518000 |
KVHUEXFOFWPACG-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50545892; PubChem:CID162660164
|
Local ready
Direct docking supported
|
|
E3L060088
BDB060088
|
BDBM50545893
Cc1ccc(Oc2ccc3nc(COc4cccc(C(=O)O)c4)n(C)c3c2C)c(C)n1
|
C24H23N3O4 417.465000 |
WNUBJWUBGFXFOH-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50545893; PubChem:CID162649019
|
Local ready
Direct docking supported
|
|
E3L060089
BDB060089
|
BDBM50545894
Cc1ccc(Oc2ccc3nc(COc4cccc(C(=O)O)c4)n(C)c3c2F)c(C)n1
|
C23H20FN3O4 421.428000 |
GHTWTHJHQYRTGW-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50545894; PubChem:CID137552745
|
Local ready
Direct docking supported
|
|
E3L060090
BDB060090
|
BDBM50545895
CCOc1cc(Oc2ncc(C)cc2C)cc2c1nc(COc1cccc(C(=O)O)c1)n2C
|
C25H25N3O5 447.491000 |
BCLXLTGJJGRZPM-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50545895; PubChem:CID162675815
|
Local ready
Direct docking supported
|
|
E3L060091
BDB060091
|
BDBM50545896
Cc1cnc(Oc2cc(OC(C)C)c3nc(COc4cccc(C(=O)O)c4)n(C)c3c2)c(C)c1
|
C26H27N3O5 461.518000 |
ULPISFOUUDRJFH-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50545896; PubChem:CID162662996
|
Local ready
Direct docking supported
|
|
E3L060092
BDB060092
|
BDBM50545897
COc1cc(Oc2cc(C)c3nc(COc4cccc(C(=O)O)c4)n(C)c3c2)ccn1
|
C23H21N3O5 419.437000 |
PPRIFTCIRPNLJT-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50545897; PubChem:CID162659595
|
Local ready
Direct docking supported
|
|
E3L060093
BDB060093
|
BDBM50545898
CCOc1cc(Oc2ccnc(OC)c2)cc2c1nc(COc1cccc(C(=O)O)c1)n2C
|
C24H23N3O6 449.463000 |
HKQNTFVDFCBUDF-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50545898; PubChem:CID162653116
|
Local ready
Direct docking supported
|
|
E3L060094
BDB060094
|
BDBM50545899
COc1cc(Oc2cc(OC(C)C)c3nc(COc4cccc(C(=O)O)c4)n(C)c3c2)ccn1
|
C25H25N3O6 463.490000 |
PAPHOLUHFJROOR-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50545899; PubChem:CID162657993
|
Local ready
Direct docking supported
|
|
E3L060095
BDB060095
|
BDBM50545900
COc1cc(Oc2ccc3nc(COc4cccc(C(=O)O)c4)n(C)c3c2F)ccn1
|
C22H18FN3O5 423.400000 |
UUQDDXDMQVZAIN-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50545900; PubChem:CID162658090
|
Local ready
Direct docking supported
|
|
E3L060096
BDB060096
|
BDBM50545901
Cc1ccc(Oc2ccc3nc(COc4cccc(C(=O)O)c4)n(C)c3c2)c(C)n1
|
C23H21N3O4 403.438000 |
SWNQXLUHHMLVFL-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50545901; PubChem:CID137552744
|
Local ready
Direct docking supported
|
|
E3L060097
BDB060097
|
BDBM50546079
C=CC(c1ccc(O)c(OC)c1)c1c(O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
|
C25H20O6 416.429000 |
AIWFCANTYRMORD-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50546079; PubChem:CID75149602
|
Local ready
Direct docking supported
|
|
E3L060098
BDB060098
|
BDBM50546080
C=CC(c1ccccc1)c1c(O)cc(O)c2c(=O)cc(-c3ccccc3)oc12
|
C24H18O4 370.404000 |
ZOHOTHWMIQFAAD-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor gamma, Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50546080; PubChem:CID15707298
|
Local ready
Direct docking supported
|
|
E3L060099
BDB060099
|
BDBM50546117
NCCO/N=C1/C(=C2/C(=O)Nc3ccc([N+](=O)[O-])cc32)Nc2ccc(O)cc21
|
C18H15N5O5 381.348000 |
XPFFDDFVHAFKNR-HPBPSMLHSA-N | O14965 | Aurora kinase A |
BindingDB
BindingDB:BDBM50546117
|
Local ready
Direct docking supported
|
|
E3L060100
BDB060100
|
BDBM50546118
CC(C)CN(C[C@H](O)[C@@H](N)c1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1
|
C19H24Cl2N2O3S 431.385000 |
YZSHYKDKXBISOU-OALUTQOASA-N | P00797 | Renin |
BindingDB, PubChem
BindingDB:BDBM50546118; PubChem:CID162660657
|
Local ready
Direct docking supported
|