| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L013601
BDB013601
|
US10144731, Example 246
Cc1ccc(C(CC(=O)O)c2ccc3c(c2)nnn3CCCNC(=O)OC(C)(C)C)cc1CN1C[C@@H](C)Oc2ccccc2S1(=O)=O
|
C34H41N5O7S 663.797000 |
YYIAYPKFORFCIY-BRIWLPCBSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304942; PubChem:CID118170026
|
Local ready
Direct docking supported
|
|
E3L013602
BDB013602
|
US10144731, Example 247
CSc1ccc(C(CC(=O)O)c2ccc(C)c(CN3C[C@@H](C)Oc4ccccc4S3(=O)=O)c2)cc1
|
C27H29NO5S2 511.665000 |
QLPRJBMOBGFKTF-PHSANKKPSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304943; PubChem:CID118170951
|
Local ready
Direct docking supported
|
|
E3L013603
BDB013603
|
US10144731, Example 248
Cc1ccc(C(CC(=O)O)c2ccc3c(c2)CCC3=O)cc1CN1C[C@@H](C)Oc2ccccc2S1(=O)=O
|
C29H29NO6S 519.619000 |
UAQJDVHSQSTTOA-OEPVSBQMSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304944; PubChem:CID118170385
|
Local ready
Direct docking supported
|
|
E3L013604
BDB013604
|
US10144731, Example 249
CC[C@@H]1CN(Cc2cc(C(CC(=O)O)c3ccc(F)cc3F)ccc2C)S(=O)(=O)c2ccccc2O1
|
C27H27F2NO5S 515.578000 |
MBIUESTWBZOSJW-FKHAVUOCSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304945; PubChem:CID118169939
|
Local ready
Direct docking supported
|
|
E3L013605
BDB013605
|
US10144731, Example 250
Cc1ccc(C(CC(=O)O)c2ccc(F)cc2F)cc1CN1C[C@@H](C)Oc2ccccc2S1(=O)=O
|
C26H25F2NO5S 501.551000 |
CYOBABBSHLGCGY-PLEWWHCXSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304946; PubChem:CID118170719
|
Local ready
Direct docking supported
|
|
E3L013606
BDB013606
|
US10144731, Example 251
COC(=O)CC(c1ccc(C)c(CN2C[C@@H](C)Oc3ccccc3S2(=O)=O)c1)c1ccc2c(c1)nnn2C
|
C28H30N4O5S 534.638000 |
QZJNRQLKRKBRDX-HWYAHNCWSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304947; PubChem:CID122653233
|
Local ready
Direct docking supported
|
|
E3L013607
BDB013607
|
US10144731, Example 252
CC(=O)c1ccc(C(CC(=O)O)c2ccc(C)c(CN3C[C@@H](C)Oc4ccccc4S3(=O)=O)c2)c(C)c1
|
C29H31NO6S 521.635000 |
HSZYGMSIEGUWCB-TUHVGIAZSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304948; PubChem:CID118169978
|
Local ready
Direct docking supported
|
|
E3L013608
BDB013608
|
US10144731, Example 253
CC[C@@H]1CN(Cc2cc(C(CC(=O)O)c3ccc(C(C)=O)cc3C)ccc2C)S(=O)(=O)c2ccccc2O1
|
C30H33NO6S 535.662000 |
FMVABZINBVIDQL-CSMDKSQMSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304949; PubChem:CID118170038
|
Local ready
Direct docking supported
|
|
E3L013609
BDB013609
|
US10144731, Example 254
Cc1ccc(C(CC(=O)O)c2ccc3c(c2)CN(C)C3=O)cc1CN1C[C@@H](C)Oc2ccccc2S1(=O)=O
|
C29H30N2O6S 534.634000 |
WWEHRWVLQHYSHD-OEPVSBQMSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304950; PubChem:CID118170253
|
Local ready
Direct docking supported
|
|
E3L013610
BDB013610
|
US10144731, Example 255
Cc1ccc(C(CC(=O)O)c2ccc3c(c2)CC(C)(C)C3=O)cc1CN1C[C@@H](C)Oc2ccccc2S1(=O)=O
|
C31H33NO6S 547.673000 |
FOIMBMUQCPZLMT-TUHVGIAZSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304951; PubChem:CID118170295
|
Local ready
Direct docking supported
|
|
E3L013611
BDB013611
|
US10144731, Example 256
CCN1C(=O)c2ccc(C(CC(=O)O)c3ccc(C)c(CN4C[C@@H](C)Oc5ccccc5S4(=O)=O)c3)cc2C1=O
|
C30H30N2O7S 562.644000 |
UHGIIBFHIWYASA-PHSANKKPSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304952; PubChem:CID118170633
|
Local ready
Direct docking supported
|
|
E3L013612
BDB013612
|
US10144731, Example 257
CC[C@@H]1CN(Cc2cc(C(CC(=O)O)c3ccc4c(c3)C(=O)N(CC)C4=O)ccc2C)S(=O)(=O)c2ccccc2O1
|
C31H32N2O7S 576.671000 |
CPMDCWKBUNBNCQ-XQZUBTRRSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304953; PubChem:CID118170041
|
Local ready
Direct docking supported
|
|
E3L013613
BDB013613
|
US10144731, Example 258
Cc1c(C(CC(=O)O)c2ccc3c(c2)C(N2C[C@@H](C)Oc4ccccc4S2(=O)=O)CC3)ccc2c1nnn2C
|
C29H30N4O5S 546.649000 |
CXZPRQFTYURHET-CVOKNGKCSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304954; PubChem:CID118169832
|
Local ready
Direct docking supported
|
|
E3L013614
BDB013614
|
US10144731, Example 259
CC[C@@H]1CN(C2CCc3ccc(C(CC(=O)O)c4ccc5c(nnn5C)c4C)cc32)S(=O)(=O)c2ccccc2O1
|
C30H32N4O5S 560.676000 |
YFUKZAAYGLSBNI-HMBUKTRKSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304955; PubChem:CID118170283
|
Local ready
Direct docking supported
|
|
E3L013615
BDB013615
|
US10144731, Example 260
Cc1c(C(CC(=O)O)c2ccc3c(c2)C(N2CC(C)Cc4ccccc4S2(=O)=O)CC3)ccc2c1nnn2C
|
C30H32N4O4S 544.677000 |
FGIULSJBSODLAD-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304956; PubChem:CID118170167
|
Local ready
Direct docking supported
|
|
E3L013616
BDB013616
|
US10144731, Example 261
Cc1c(C(CC(=O)O)c2ccc3c(c2)C(N2CC(C)Cc4ccc(Br)cc4S2(=O)=O)CC3)ccc2c1nnn2C
|
C30H31BrN4O4S 623.573000 |
ZHMFLGKJTRLMKZ-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304957; PubChem:CID118170640
|
Local ready
Direct docking supported
|
|
E3L013617
BDB013617
|
BDBM304959
Cc1c2ccc3c1nnn3CCCCCC1CN(C3CCc4ccc(cc43)C2CC(=O)O)S(=O)(=O)c2ccccc2O1
|
C32H34N4O5S 586.714000 |
VMBGZHLUBXWENN-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM304959
|
Local ready
Direct docking supported
|
|
E3L013618
BDB013618
|
US10144731, Example 265
Cc1ccc2cc1CN1CC(CCCCCn3nnc4c(C)c(ccc43)C2CC(=O)O)Oc2ccccc2S1(=O)=O
|
C31H34N4O5S 574.703000 |
FEAUSMUUPSCPKO-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM304961; PubChem:CID122660656
|
Local ready
Direct docking supported
|
|
E3L013619
BDB013619
|
BDBM304962
Cc1ccc2cc1CN1CC(CCC=CCn3nnc4c(C)c(ccc43)C2CC(=O)O)Oc2ccccc2S1(=O)=O
|
C31H32N4O5S 572.687000 |
UOLHWQPOVKEGJH-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM304962
|
Local ready
Direct docking supported
|
|
E3L013620
BDB013620
|
BDBM304963
Cc1c2ccc3c1nnn3CC=CCCC1CN(C3CCc4ccc(cc43)C2CC(=O)O)S(=O)(=O)c2ccccc2O1
|
C32H32N4O5S 584.698000 |
HHKMNRGIWAHEIR-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM304963
|
Local ready
Direct docking supported
|