| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L061661
BDB061661
|
BDBM50584835
CN(C)C(=O)[C@H]1CSCc2ccccc2C(=O)OC[C@@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2Oc2ccccc2C#N)C(=O)N1
|
C35H35N5O7S 669.760000 |
QQKWHOLEMOJAES-FCEKVYKBSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584835
|
Local ready
Direct docking supported
|
|
E3L061662
BDB061662
|
BDBM50584836
CN(C)C(=O)[C@H]1CSCc2ccccc2C(=O)OC[C@@H](NC(=O)[C@@H]2CCCN2C(=O)c2cccc(-n3ccnc3)n2)C(=O)N1
|
C30H33N7O6S 619.704000 |
WRHVEWAJOJYGJX-SMIHKQSGSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584836
|
Local ready
Direct docking supported
|
|
E3L061663
BDB061663
|
BDBM50584837
CN(C)C(=O)[C@H]1CSCc2ccccc2C(=O)OC[C@@H](NC(=O)[C@@H]2CCCN2C(=O)CNC(=O)C2(c3ccccc3)CC2)C(=O)N1
|
C33H39N5O7S 649.770000 |
SKVRTRXQLPJVDW-CYXNTTPDSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584837
|
Local ready
Direct docking supported
|
|
E3L061664
BDB061664
|
BDBM50584838
Cc1cc(=O)[nH]c(SCC(=O)N2CCC[C@H]2C(=O)N[C@@H]2COC(=O)c3ccccc3CSC[C@H](C(=O)N(C)C)NC2=O)c1C#N
|
C30H34N6O7S2 654.771000 |
JQJGMUYCIHEJOT-ZLNRFVROSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584838
|
Local ready
Direct docking supported
|
|
E3L061665
BDB061665
|
BDBM50584839
CN(C)C(=O)[C@H]1CSCc2ccccc2C(=O)OC[C@@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2C(=O)O)C(=O)N1
|
C29H32N4O8S 596.662000 |
ZIYXBEWESNLNKO-ZLNRFVROSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584839
|
Local ready
Direct docking supported
|
|
E3L061666
BDB061666
|
BDBM50584840
CN(C)C(=O)[C@H]1CSCc2ccccc2C(=O)OC[C@@H](NC(=O)[C@@H]2CCCN2C(=O)CSc2ccccc2C(=O)O)C(=O)N1
|
C30H34N4O8S2 642.756000 |
YXTNPSRXQJCEBS-ZLNRFVROSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584840
|
Local ready
Direct docking supported
|
|
E3L061667
BDB061667
|
BDBM50584841
CN(C)C(=O)[C@H]1CSCc2ccccc2C(=O)OC[C@@H](NC(=O)[C@@H]2CCCN2C(=O)c2cccc(N3N=C(C(=O)O)CCC3=O)c2)C(=O)N1
|
C33H36N6O9S 692.751000 |
CXDVYOKDPJHCIL-CYXNTTPDSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584841
|
Local ready
Direct docking supported
|
|
E3L061668
BDB061668
|
BDBM50584842
Cc1cc(C(=O)N2CCC[C@H]2C(=O)N[C@@H]2COC(=O)c3ccccc3CSC[C@H](C(=O)N(C)C)NC2=O)c(C(=O)O)s1
|
C28H32N4O8S2 616.718000 |
TWUXPSJXKNUNMK-NJYVYQBISA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584842
|
Local ready
Direct docking supported
|
|
E3L061669
BDB061669
|
BDBM50584843
CN(C)C(=O)[C@H]1CSCc2ccccc2C(=O)OC[C@@H](NC(=O)[C@@H]2CCCN2C(=O)c2sccc2NS(C)(=O)=O)C(=O)N1
|
C27H33N5O8S3 651.789000 |
OLJUJSIQYXSBJH-NJYVYQBISA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584843
|
Local ready
Direct docking supported
|
|
E3L061670
BDB061670
|
BDBM50584844
CC(=O)N1CCC[C@H]1C(=O)N[C@@H]1COC(=O)c2cccc(-c3ccccc3)c2CSC[C@H](C(=O)N(C)C)NC1=O
|
C29H34N4O6S 566.680000 |
HCZXTZDELJQRFC-SDHSZQHLSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584844
|
Local ready
Direct docking supported
|
|
E3L061671
BDB061671
|
BDBM50584845
CC(=O)N1CCC[C@H]1C(=O)N[C@@H]1COC(=O)c2cccc(-c3cccc4nonc34)c2CSC[C@H](C(=O)N(C)C)NC1=O
|
C29H32N6O7S 608.677000 |
OENFEWXUJYIDRB-SMIHKQSGSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584845
|
Local ready
Direct docking supported
|
|
E3L061672
BDB061672
|
BDBM50584846
CC(=O)N1CCC[C@H]1C(=O)N[C@@H]1COC(=O)c2cccc(-c3ccc4nonc4c3)c2CSC[C@H](C(=O)N(C)C)NC1=O
|
C29H32N6O7S 608.677000 |
JADPXRRVFLVLQD-SDHSZQHLSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584846
|
Local ready
Direct docking supported
|
|
E3L061673
BDB061673
|
BDBM50584847
CC(=O)N1CCC[C@H]1C(=O)N[C@@H]1COC(=O)c2cccc(-c3ccc(C#N)s3)c2CSC[C@H](C(=O)N(C)C)NC1=O
|
C28H31N5O6S2 597.719000 |
RPKQCRNTSPMMMI-ZLNRFVROSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584847
|
Local ready
Direct docking supported
|
|
E3L061674
BDB061674
|
BDBM50584848
CC(=O)N1CCC[C@H]1C(=O)N[C@@H]1COC(=O)c2cccc(-c3cccc(C(=O)O)c3)c2CSC[C@H](C(=O)N(C)C)NC1=O
|
C30H34N4O8S 610.689000 |
UPESAAPZKADZIE-SDHSZQHLSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584848
|
Local ready
Direct docking supported
|
|
E3L061675
BDB061675
|
BDBM50584849
COC(=O)c1ccc(-c2cccc3c2CSC[C@H](C(=O)N(C)C)NC(=O)[C@H](NC(=O)[C@@H]2CCCN2C(C)=O)COC3=O)cc1
|
C31H36N4O8S 624.716000 |
IQUXPEZGFSJPFM-CYXNTTPDSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584849
|
Local ready
Direct docking supported
|
|
E3L061676
BDB061676
|
BDBM50584850
CC(=O)N1CCC[C@H]1C(=O)N[C@@H]1COC(=O)c2cccc(-c3ccc(CC(=O)O)cc3)c2CSC[C@H](C(=O)N(C)C)NC1=O
|
C31H36N4O8S 624.716000 |
DNCVBTDEWWNOCO-CYXNTTPDSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584850
|
Local ready
Direct docking supported
|
|
E3L061677
BDB061677
|
BDBM50584851
CC(=O)N1CCC[C@H]1C(=O)N[C@@H]1COC(=O)c2cccc(-c3ccc(C(=O)O)s3)c2CSC[C@H](C(=O)N(C)C)NC1=O
|
C28H32N4O8S2 616.718000 |
HWZVIVVGNNUAAA-NJYVYQBISA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584851
|
Local ready
Direct docking supported
|
|
E3L061678
BDB061678
|
BDBM50584852
CC(=O)N1CCC[C@H]1C(=O)N[C@@H]1COC(=O)c2cccc(-c3ccc(-c4nnn[nH]4)cc3)c2CSC[C@H](C(=O)N(C)C)NC1=O
|
C30H34N8O6S 634.719000 |
ZKCZPLVUPCCEOU-SDHSZQHLSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584852
|
Local ready
Direct docking supported
|
|
E3L061679
BDB061679
|
BDBM50584853
CC(=O)N1CCC[C@H]1C(=O)N[C@@H]1COC(=O)c2cccc(-c3ccc([N+](=O)[O-])cc3)c2CSC[C@H](C(=O)N(C)C)NC1=O
|
C29H33N5O8S 611.677000 |
DEZZJARWAMZBLP-SDHSZQHLSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584853
|
Local ready
Direct docking supported
|
|
E3L061680
BDB061680
|
BDBM50584854
CC(=O)N1CCC[C@H]1C(=O)N[C@@H]1COC(=O)c2cccc(-c3ccc(S(C)(=O)=O)cc3)c2CSC[C@H](C(=O)N(C)C)NC1=O
|
C30H36N4O8S2 644.772000 |
WBOFBTRBBYVTGY-CYXNTTPDSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50584854
|
Local ready
Direct docking supported
|