| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L030581
BDB030581
|
US20230271937, Example C4-1-2
NC(=O)CN1CCC(CO)(CNc2ncnc(N(Cc3ccc(C(F)(F)F)cc3)C3CC3)c2F)[C@@H](O)C1
|
C24H30F4N6O3 526.535000 |
CXMOYPLATUCURY-XNUZUHMRSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614939; PubChem:CID168678329
|
Local ready
Direct docking supported
|
|
E3L030582
BDB030582
|
US20230271937, Example D5-1-1-1
CCN(Cc1ccc(C(F)(F)F)cc1)c1ncnc(NC[C@]2(O)CCN(CC(N)=O)C[C@H]2O)c1F
|
C22H28F4N6O3 500.497000 |
SQRKBZBTGSHSCV-IIBYNOLFSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614940; PubChem:CID156497002
|
Local ready
Direct docking supported
|
|
E3L030583
BDB030583
|
US20230271937, Example D5-1-1-2
CCN(Cc1ccc(C(F)(F)F)cc1)c1ncnc(NC[C@]2(O)CCN(CC(N)=O)C[C@@H]2O)c1F
|
C22H28F4N6O3 500.497000 |
SQRKBZBTGSHSCV-HRAATJIYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614941; PubChem:CID156497111
|
Local ready
Direct docking supported
|
|
E3L030584
BDB030584
|
US20230271937, Example D5-2-1-1
NC(=O)CN1CC[C@@](O)(CNc2ncnc(N(Cc3ccc(C(F)(F)F)cc3)C3CC3)c2F)[C@H](O)C1
|
C23H28F4N6O3 512.508000 |
XZJMOTROTMBERZ-VGOFRKELSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614942; PubChem:CID156497132
|
Local ready
Direct docking supported
|
|
E3L030585
BDB030585
|
US20230271937, Example D5-2-1-2
NC(=O)CN1CC[C@@](O)(CNc2ncnc(N(Cc3ccc(C(F)(F)F)cc3)C3CC3)c2F)[C@@H](O)C1
|
C23H28F4N6O3 512.508000 |
XZJMOTROTMBERZ-HTAPYJJXSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614943; PubChem:CID156511788
|
Local ready
Direct docking supported
|
|
E3L030586
BDB030586
|
US20230271937, Example D5-3-1-1
CCN(Cc1ccc(C(F)(F)F)cc1F)c1ncnc(NC[C@]2(O)CCN(CC(N)=O)C[C@H]2O)c1F
|
C22H27F5N6O3 518.487000 |
RITHJYFFTSXICU-IIBYNOLFSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614946; PubChem:CID156496954
|
Local ready
Direct docking supported
|
|
E3L030587
BDB030587
|
US20230271937, Example D5-3-1-2
CCN(Cc1ccc(C(F)(F)F)cc1F)c1ncnc(NC[C@]2(O)CCN(CC(N)=O)C[C@@H]2O)c1F
|
C22H27F5N6O3 518.487000 |
RITHJYFFTSXICU-HRAATJIYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614947; PubChem:CID156497016
|
Local ready
Direct docking supported
|
|
E3L030588
BDB030588
|
US20230271937, Example D5-4
CCN(Cc1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1)c1ncnc(NC[C@]2(O)CCN(CC(N)=O)C[C@H]2O)c1F
|
C24H29F7N6O4 598.520000 |
SBUXCOKMXBEELC-IIBYNOLFSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614948; PubChem:CID156496998
|
Local ready
Direct docking supported
|
|
E3L030589
BDB030589
|
US20230271937, Example D5-5-1
Cn1cc(-c2ccc(CN(c3ncnc(NC[C@]4(O)CCN(CC(N)=O)C[C@H]4O)c3F)C3CC3)c(F)c2)cn1
|
C26H32F2N8O3 542.591000 |
KBANFLDCYJBJRN-QFQXNSOFSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614949; PubChem:CID156496905
|
Local ready
Direct docking supported
|
|
E3L030590
BDB030590
|
US20230271937, Example D5-5-2
Cn1cc(-c2ccc(CN(c3ncnc(NC[C@]4(O)CCN(CC(N)=O)C[C@@H]4O)c3F)C3CC3)c(F)c2)cn1
|
C26H32F2N8O3 542.591000 |
KBANFLDCYJBJRN-HFZDXXHNSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614950; PubChem:CID168678330
|
Local ready
Direct docking supported
|
|
E3L030591
BDB030591
|
US20230271937, Example D5-6
NC(=O)CN1CC[C@@](O)(CNc2ncnc(N(Cc3ccc(C(O)(C(F)(F)F)C(F)(F)F)cc3)C3CC3)c2F)[C@H](O)C1
|
C25H29F7N6O4 610.531000 |
OTNMVAVLMWKALG-VGOFRKELSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614951; PubChem:CID156497061
|
Local ready
Direct docking supported
|
|
E3L030592
BDB030592
|
US20230271937, Example D5-7
NC(=O)CN1CC[C@@](O)(CNc2ncnc(N(Cc3ccc(C(O)(C(F)(F)F)C(F)(F)F)cc3)C3CC3)c2F)[C@@H](O)C1
|
C25H29F7N6O4 610.531000 |
OTNMVAVLMWKALG-HTAPYJJXSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614952; PubChem:CID168678331
|
Local ready
Direct docking supported
|
|
E3L030593
BDB030593
|
US20230271937, Example D5-7-1
CCN(Cc1ccc(C(F)(F)F)cc1)c1ncnc(NC[C@@]2(O)CCN(C(C(N)=O)c3ccncc3)C[C@@H]2O)c1F
|
C27H31F4N7O3 577.583000 |
CFVILLASPBTNFN-GCNITNNDSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614953; PubChem:CID156496926
|
Local ready
Direct docking supported
|
|
E3L030594
BDB030594
|
US20230271937, Example D5-7-2
CCN(Cc1ccc(C(F)(F)F)cc1)c1ncnc(NC[C@@]2(O)CCN(C(C(N)=O)c3ccncc3)C[C@H]2O)c1F
|
C27H31F4N7O3 577.583000 |
CFVILLASPBTNFN-GVHMNUMSSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614954; PubChem:CID168678332
|
Local ready
Direct docking supported
|
|
E3L030595
BDB030595
|
US20230271937, Example D5-8
NC(=O)C(c1ccncc1)N1CC[C@@](O)(CNc2ncnc(N(Cc3ccc(C(F)(F)F)cc3)C3CC3)c2F)[C@H](O)C1
|
C28H31F4N7O3 589.594000 |
FEHXOCUGJGJHRR-QIAUEJHGSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614955; PubChem:CID156496937
|
Local ready
Direct docking supported
|
|
E3L030596
BDB030596
|
US20230271937, Example D5-9
NC(=O)CN1CC[C@](O)(CNc2ncnc(N(Cc3ccc(-n4cccn4)cc3F)C3CC3)c2F)[C@@H](O)C1
|
C25H30F2N8O3 528.564000 |
FOCNSIGSUXLYGI-CPJSRVTESA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614956; PubChem:CID156511736
|
Local ready
Direct docking supported
|
|
E3L030597
BDB030597
|
US20230271937, Example D5-10
NC(=O)CN1CC[C@](O)(CNc2ncnc(N(Cc3ccccc3F)C3CC3)c2F)[C@@H](O)C1
|
C22H28F2N6O3 462.501000 |
GSBNXXWJASYILX-JTSKRJEESA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614957; PubChem:CID156511696
|
Local ready
Direct docking supported
|
|
E3L030598
BDB030598
|
US20230271937, Example E6-1
NC(=O)CN1CCC(N)(CNc2ncnc(N(Cc3ccc(C(F)(F)F)cc3)C3CC3)c2F)CC1
|
C23H29F4N7O 495.525000 |
WLPKWONTGYSMHN-UHFFFAOYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614958; PubChem:CID156496988
|
Local ready
Direct docking supported
|
|
E3L030599
BDB030599
|
US20230271937, Example F2-03
CN(Cc1cccc(Cl)c1Cl)c1ncnc(NC[C@H]2CCN(CC(N)=O)C[C@@H]2O)c1F
|
C20H25Cl2FN6O2 471.364000 |
BZWDWEWMNWMITD-DOMZBBRYSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614959; PubChem:CID156496933
|
Local ready
Direct docking supported
|
|
E3L030600
BDB030600
|
US20230271937, Example F2-06
CC(c1ccccc1Cl)N(C)c1ncnc(NC[C@H]2CCN(CC(N)=O)C[C@@H]2O)c1F
|
C21H28ClFN6O2 450.946000 |
BGMIXOJSLFXIHV-ROFXEPAZSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614960; PubChem:CID156497020
|
Local ready
Direct docking supported
|