| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L059941
BDB059941
|
BDBM50540564
CC(C)(Oc1ccc(CCOc2ccc(NC(=O)c3ccccc3)cc2)cc1)C(=O)Nc1ccccc1
|
C31H30N2O4 494.591000 |
BMLOPJYGLSCLGH-UHFFFAOYSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50540564; PubChem:CID156020214
|
Local ready
Direct docking supported
|
|
E3L059942
BDB059942
|
BDBM50540565
CC(C)(Oc1ccc(CCOc2ccc(NC(=O)c3ccccc3)cc2)cc1)C(=O)NCc1ccccc1
|
C32H32N2O4 508.618000 |
IGJNCCKFSZDAHR-UHFFFAOYSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50540565; PubChem:CID156016078
|
Local ready
Direct docking supported
|
|
E3L059943
BDB059943
|
BDBM50540566
CC(C)(Oc1ccc(CCOc2ccc(NC(=O)c3ccccc3)cc2)cc1)C(=O)NS(=O)(=O)c1ccccc1
|
C31H30N2O6S 558.656000 |
OOLLWGWRWQKZIF-UHFFFAOYSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50540566; PubChem:CID156012847
|
Local ready
Direct docking supported
|
|
E3L059944
BDB059944
|
BDBM50540567
CC(C)(Oc1ccc(CCOc2ccc(NC(=O)Nc3ccccc3)cc2)cc1)C(N)=O
|
C25H27N3O4 433.508000 |
VJLOACVLEMHBTM-UHFFFAOYSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50540567; PubChem:CID156020378
|
Local ready
Direct docking supported
|
|
E3L059945
BDB059945
|
BDBM50540568
CCCCNC(=O)C(C)(C)Oc1ccc(CCOc2ccc(NC(=O)Nc3ccccc3)cc2)cc1
|
C29H35N3O4 489.616000 |
WIGVJWVVWSUJEX-UHFFFAOYSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50540568; PubChem:CID156014513
|
Local ready
Direct docking supported
|
|
E3L059946
BDB059946
|
BDBM50540569
CC(C)(Oc1ccc(CCOc2ccc(NC(=O)Nc3ccccc3)cc2)cc1)C(=O)Nc1ccccc1
|
C31H31N3O4 509.606000 |
CSJLGRKBPSECCD-UHFFFAOYSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50540569; PubChem:CID156013625
|
Local ready
Direct docking supported
|
|
E3L059947
BDB059947
|
BDBM50540570
CC(C)(Oc1ccc(CCOc2ccc(NC(=O)Nc3ccccc3)cc2)cc1)C(=O)NCc1ccccc1
|
C32H33N3O4 523.633000 |
XJGBRMNMZPOORX-UHFFFAOYSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50540570; PubChem:CID156013488
|
Local ready
Direct docking supported
|
|
E3L059948
BDB059948
|
BDBM50540571
CC(C)(Oc1ccc(CCOc2ccc(NC(=O)Nc3ccccc3)cc2)cc1)C(=O)NS(=O)(=O)c1ccccc1
|
C31H31N3O6S 573.671000 |
OBXRHFHMEUTXQC-UHFFFAOYSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50540571; PubChem:CID156009826
|
Local ready
Direct docking supported
|
|
E3L059949
BDB059949
|
BDBM50540618
NC(=O)[C@H]1CC[C@H]1C(=O)N1CCc2c(OCCO)cccc2[C@H]1CN1C(=O)c2ccccc2C1=O
|
C26H27N3O6 477.517000 |
XWMQKSXJPOIISN-IOMROCGXSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50540618
|
Local ready
Direct docking supported
|
|
E3L059950
BDB059950
|
BDBM50540619
O=C(O)[C@H]1CC[C@H]1C(=O)N1CCc2c(OCCO)cccc2[C@H]1CN1C(=O)c2ccccc2C1=O
|
C26H26N2O7 478.501000 |
BAJHKNYLTRBBRP-QHAWAJNXSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50540619; PubChem:CID156021956
|
Local ready
Direct docking supported
|
|
E3L059951
BDB059951
|
BDBM50540620
NC(=O)[C@H]1CCCC[C@H]1C(=O)N1CCc2c(O)cccc2[C@H]1CN1C(=O)c2ccccc2C1=O
|
C26H27N3O5 461.518000 |
HZNASZKZGGDBHO-WAOWUJCRSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50540620; PubChem:CID156016086
|
Local ready
Direct docking supported
|
|
E3L059952
BDB059952
|
BDBM50540621
NC(=O)[C@H]1CC[C@H]1C(=O)N1CCc2c(O)cccc2[C@H]1CN1C(=O)c2ccccc2C1=O
|
C24H23N3O5 433.464000 |
UIJXPBABJIYKKJ-KFKAGJAMSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50540621; PubChem:CID156017875
|
Local ready
Direct docking supported
|
|
E3L059953
BDB059953
|
BDBM50540622
O=C(O)[C@H]1CC[C@H]1C(=O)N1CCc2c(O)cccc2[C@H]1CN1C(=O)c2ccccc2C1=O
|
C24H22N2O6 434.448000 |
BSPRKRGBUXZXMO-CEXWTWQISA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50540622; PubChem:CID156012824
|
Local ready
Direct docking supported
|
|
E3L059954
BDB059954
|
Ac-Leu-Asp-Glu-Glu-Thr-Gly-Phe-Phe-Leu-NH2
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(N)=O)[C@@H](C)O
|
C52H74N10O17 1111.217000 |
WLYUAFUSQYAPQZ-BGKUUGFZSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50540623; PubChem:CID156021621
|
Local ready
Direct docking supported
|
|
E3L059955
BDB059955
|
Ac-Leu-Asp-Glu-Glu-Thr-Gly-Phe(3-CONH2)-Phe-Leu-NH2
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1cccc(C(N)=O)c1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(N)=O)[C@@H](C)O
|
C53H75N11O18 1154.242000 |
DMXIZGOTPZWDER-JYOBDFOLSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50540624; PubChem:CID156020939
|
Local ready
Direct docking supported
|
|
E3L059956
BDB059956
|
BDBM50540625
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC1CCCC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(N)=O)[C@@H](C)O
|
C51H78N10O17 1103.238000 |
AWCRWJKVBPLDIQ-FBCVKHONSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50540625; PubChem:CID156011324
|
Local ready
Direct docking supported
|
|
E3L059957
BDB059957
|
Ac-Leu-Asp-Glu-Glu-Thr-Gly-Arg-Phe-Leu-NH2
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(N)=O)[C@@H](C)O
|
C49H77N13O17 1120.229000 |
RWNBAPQFKKCPGB-BMISOUISSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50540626; PubChem:CID156010003
|
Local ready
Direct docking supported
|
|
E3L059958
BDB059958
|
Ac-Leu-Asp-Glu-Glu-Thr-Gly-Ala(cPr)(cPr)-Phe-Leu-NH2
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC1CC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(N)=O)[C@@H](C)O
|
C49H74N10O17 1075.184000 |
MLXNRHSHFIOBGF-GFOUBMQCSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50540627; PubChem:CID156012308
|
Local ready
Direct docking supported
|
|
E3L059959
BDB059959
|
Ac-Leu-Asp-Glu-Glu-Thr-Gly-Ala(cBu)-Phe-Leu-NH2
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC1CCC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(N)=O)[C@@H](C)O
|
C50H76N10O17 1089.211000 |
HGIKAEYXAZAQII-SPLDJXROSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50540628; PubChem:CID156016642
|
Local ready
Direct docking supported
|
|
E3L059960
BDB059960
|
BDBM50540629
O=C(O)[C@H]1CCCC[C@H]1C(=O)N1CCc2c(O)cccc2[C@H]1CN1C(=O)c2ccccc2C1=O
|
C26H26N2O6 462.502000 |
QXLVHVOZQMMQLQ-QHAWAJNXSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50540629; PubChem:CID156013221
|
Local ready
Direct docking supported
|