| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L013461
BDB013461
|
US10144731, Example 88
Cc1ccc(C(CC(=O)O)c2ccc3c(nnn3C)c2F)cc1CN1C[C@@H](C)Oc2ccccc2S1(=O)=O
|
C27H27FN4O5S 538.601000 |
ZHDBZJLNJLJQMN-OQHSHRKDSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304790; PubChem:CID118170198
|
Local ready
Direct docking supported
|
|
E3L013462
BDB013462
|
US10144731, Example 89
COc1cc(C(CC(=O)O)c2ccc(C)c(CN(C)C(=O)OC3CCCC3)c2)c(C)c2nnn(C)c12
|
C27H34N4O5 494.592000 |
FICRVLXLXMNVDH-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304791; PubChem:CID118170796
|
Local ready
Direct docking supported
|
|
E3L013463
BDB013463
|
US10144731, Example 90
Cc1ccc(C(CC(=O)O)c2ccc3c(nnn3C)c2C)cc1CN(C)S(=O)(=O)C1CCCC1
|
C25H32N4O4S 484.622000 |
TYEFYUBZAKPDAX-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304792; PubChem:CID118170150
|
Local ready
Direct docking supported
|
|
E3L013464
BDB013464
|
US10144731, Example 91
Cc1ccc(C(CC(=O)OCC(=O)N(C)C)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C32H38N6O5S 618.760000 |
MDSPUIITKWGXGF-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304793; PubChem:CID118170105
|
Local ready
Direct docking supported
|
|
E3L013465
BDB013465
|
US10144731, Example 92
Cc1ccc(C(CC(=O)OCc2oc(=O)oc2C)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C33H35N5O7S 645.738000 |
RZULNVGERYOKPS-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304794; PubChem:CID118169810
|
Local ready
Direct docking supported
|
|
E3L013466
BDB013466
|
US10144731, Example 93
Cc1ccc(C(CC(=O)OCCO)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C30H35N5O5S 577.707000 |
XZTMQDGKWVWWGY-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304795; PubChem:CID118170672
|
Local ready
Direct docking supported
|
|
E3L013467
BDB013467
|
US10144731, Example 95
Cc1ccc(C(CC(=O)OCCN(C)C)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C32H40N6O4S 604.777000 |
KXTXQGKARMHJOC-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304796; PubChem:CID118170179
|
Local ready
Direct docking supported
|
|
E3L013468
BDB013468
|
US10144731, Example 96
Cc1ccc(C(CC(=O)OCCN2CCOCC2)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C34H42N6O5S 646.814000 |
VKGHEMQKRSKYMO-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304797; PubChem:CID118170035
|
Local ready
Direct docking supported
|
|
E3L013469
BDB013469
|
US10144731, Example 97
Cc1ccc(C(CC(=O)OCCCN(C)C)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C33H42N6O4S 618.804000 |
WJQRKZLHDLFVLR-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304798; PubChem:CID118169861
|
Local ready
Direct docking supported
|
|
E3L013470
BDB013470
|
US10144731, Example 98
Cc1ccc(C(CC(=O)OC2CCOC2=O)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C32H35N5O6S 617.728000 |
ACCKTIQSNBFAGE-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304799; PubChem:CID118170791
|
Local ready
Direct docking supported
|
|
E3L013471
BDB013471
|
US10144731, Example 99
Cc1ccc(C(CC(=O)OCOC(=O)C(C)(C)C)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C34H41N5O6S 647.798000 |
QAHKYUWDTOFNKE-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304800; PubChem:CID118170658
|
Local ready
Direct docking supported
|
|
E3L013472
BDB013472
|
US10144731, Example 100
Cc1ccc(C(CC(=O)OCCCN)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C31H38N6O4S 590.750000 |
GILCRRBNMVEERS-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304801; PubChem:CID118170625
|
Local ready
Direct docking supported
|
|
E3L013473
BDB013473
|
US10144731, Example 101
Cc1ccc(C(CC(=O)OCC(N)C(C)C)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C33H42N6O4S 618.804000 |
PRDDRPQTESJCMJ-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304802; PubChem:CID118170510
|
Local ready
Direct docking supported
|
|
E3L013474
BDB013474
|
US10144731, Example 102
Cc1ccc(C(CC(=O)OCCn2ccnc2)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C33H37N7O4S 627.771000 |
FPLJRFMRUAYRHK-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304803; PubChem:CID118188787
|
Local ready
Direct docking supported
|
|
E3L013475
BDB013475
|
US10144731, Example 103
CCN(CC)CCCOC(=O)CC(c1ccc(C)c(CN2CCN(C)c3ccccc3S2(=O)=O)c1)c1ccc2c(nnn2C)c1C
|
C35H46N6O4S 646.858000 |
NSXJQKAKTZTGPQ-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304804; PubChem:CID118170172
|
Local ready
Direct docking supported
|
|
E3L013476
BDB013476
|
US10144731, Example 104
Cc1ccc(C(CC(=O)OCCCCN(C)C)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C34H44N6O4S 632.831000 |
UHZFHXHECXKUIN-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304805; PubChem:CID118169783
|
Local ready
Direct docking supported
|
|
E3L013477
BDB013477
|
US10144731, Example 105
Cc1ccc(C(CC(=O)OCC(C)(C)CN(C)C)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C35H46N6O4S 646.858000 |
VNXBBGNOTHOKLU-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304806; PubChem:CID118188857
|
Local ready
Direct docking supported
|
|
E3L013478
BDB013478
|
US10144731, Example 106
Cc1ccc(C(CC(=O)OCCCN2CCCC2)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C35H44N6O4S 644.842000 |
RYATWPZKKNYZPW-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304807; PubChem:CID118170197
|
Local ready
Direct docking supported
|
|
E3L013479
BDB013479
|
US10144731, Example 107
Cc1ccc(C(CC(=O)OC(C)CN(C)C)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C33H42N6O4S 618.804000 |
XGHQHSHDBJZAOQ-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304808; PubChem:CID118170645
|
Local ready
Direct docking supported
|
|
E3L013480
BDB013480
|
US10144731, Example 108
Cc1ccc(C(CC(=O)OCCCN2CCOCC2)c2ccc3c(nnn3C)c2C)cc1CN1CCN(C)c2ccccc2S1(=O)=O
|
C35H44N6O5S 660.841000 |
QHHJBFGEOQGEIC-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304809; PubChem:CID118170771
|
Local ready
Direct docking supported
|