| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L033641
BDB033641
|
BDBM669893
CC[C@@H]1CN(Cc2cc(C(c3cc(C)c(C(C)=O)s3)C(C)C(=O)O)ccc2C)S(=O)(=O)c2ccccc2O1
|
C29H33NO6S2 555.718000 |
PBOSLYHQUNRTOY-AHKKLNPASA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM669893
|
Local ready
Direct docking supported
|
|
E3L033642
BDB033642
|
BDBM669894
CC[C@@H]1CN(Cc2cc(C(c3cc(C(C)=O)cs3)C(C)C(=O)O)ccc2C)S(=O)(=O)c2ccccc2O1
|
C28H31NO6S2 541.691000 |
OODKCDXCHUIIJP-QTDGRNKISA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM669894
|
Local ready
Direct docking supported
|
|
E3L033643
BDB033643
|
BDBM669895
CC[C@@H]1CN(Cc2cc(C(c3cc(OC)c(C(C)=O)s3)C(C)(C)C(=O)O)ccc2C)S(=O)(=O)c2ccccc2O1
|
C30H35NO7S2 585.744000 |
RRXNHEMQVUMIAY-XVPAFAEQSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM669895
|
Local ready
Direct docking supported
|
|
E3L033644
BDB033644
|
BDBM669896
CC[C@@H]1CN(Cc2cc(C(CC(=O)O)c3ccc(C(C)=O)s3)ccc2C)S(=O)(=O)c2ccccc2O1
|
C27H29NO6S2 527.664000 |
UOMIMIAQTGWDOH-ZMFCMNQTSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM669896; PubChem:CID155466615
|
Local ready
Direct docking supported
|
|
E3L033645
BDB033645
|
BDBM669897
CC[C@@H]1CN(Cc2cc(C(c3ccc(C(C)=O)s3)C(C)(C)C(=O)O)ccc2C)S(=O)(=O)c2ccccc2O1
|
C29H33NO6S2 555.718000 |
TYHVFVHARPQCJC-XVPAFAEQSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM669897
|
Local ready
Direct docking supported
|
|
E3L033646
BDB033646
|
BDBM669898
CC[C@@H]1CN(Cc2cc(C(CC(=O)O)c3cc(C)c(C(C)=O)s3)ccc2C)S(=O)(=O)c2ccccc2O1
|
C28H31NO6S2 541.691000 |
XZNQBOQGKVXDGA-WTQRLHSKSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM669898; PubChem:CID155466510
|
Local ready
Direct docking supported
|
|
E3L033647
BDB033647
|
BDBM669899
CC[C@@H]1CN(Cc2cc(C(CC(=O)O)c3cc(F)c(C(C)=O)s3)ccc2C)S(=O)(=O)c2ccccc2O1
|
C27H28FNO6S2 545.654000 |
VYYNFEWQQNYGEU-VQCQRNETSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM669899
|
Local ready
Direct docking supported
|
|
E3L033648
BDB033648
|
BDBM669900
CC[C@@H]1CN(Cc2cc(C(c3ccc(C(C)=O)s3)C(C)(C)C(=O)O)ccc2C)S(=O)(=O)c2c(F)cccc2O1
|
C29H32FNO6S2 573.708000 |
FCRXBQKBRLUUAQ-OSMGYRLQSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM669900
|
Local ready
Direct docking supported
|
|
E3L033649
BDB033649
|
BDBM669901
CC[C@@H]1CN(Cc2cc(C(CC(=O)O)c3cc(C(C)=O)cs3)ccc2C)S(=O)(=O)c2ccccc2O1
|
C27H29NO6S2 527.664000 |
UGQFORGTVTXEAK-WTQRLHSKSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM669901; PubChem:CID155466732
|
Local ready
Direct docking supported
|
|
E3L033650
BDB033650
|
BDBM669902
CC[C@@H]1CN(Cc2cc(C(c3cc(F)c(C(C)=O)s3)C(C)(C)C(=O)O)ccc2C)S(=O)(=O)c2ccccc2O1
|
C29H32FNO6S2 573.708000 |
VARRBXFJQLPPCL-OSMGYRLQSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM669902
|
Local ready
Direct docking supported
|
|
E3L033651
BDB033651
|
BDBM669903
CC(=O)c1ccc(C(c2ccc(C)c(CN3C[C@@H](C)Oc4ccccc4S3(=O)=O)c2)C(C)(C)C(=O)O)s1
|
C28H31NO6S2 541.691000 |
IWXWSWZSOWORDW-QOBPCVTDSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM669903
|
Local ready
Direct docking supported
|
|
E3L033652
BDB033652
|
BDBM669904
CC(=O)c1ccc(C(c2ccc(C)c(CN3CC(CCOc4ccccc4)Oc4ccccc4S3(=O)=O)c2)C(C)C(=O)O)s1
|
C34H35NO7S2 633.788000 |
SDBGKLJKVGXOQX-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM669904
|
Local ready
Direct docking supported
|
|
E3L033653
BDB033653
|
BDBM669905
CC[C@@H]1CN(Cc2cc(C(CC(=O)O)c3sc(C(C)=O)cc3C)ccc2C)S(=O)(=O)c2ccccc2O1
|
C28H31NO6S2 541.691000 |
VDPWJXKIOQXHEF-WTQRLHSKSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM669905
|
Local ready
Direct docking supported
|
|
E3L033654
BDB033654
|
BDBM669906
CC[C@@H]1CN(Cc2cc(C(CC(=O)O)c3csc(C(C)=O)c3)ccc2C)S(=O)(=O)c2ccccc2O1
|
C27H29NO6S2 527.664000 |
KIUDFMORXVNFKD-WTQRLHSKSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM669906; PubChem:CID155466703
|
Local ready
Direct docking supported
|
|
E3L033655
BDB033655
|
BDBM669907
CC[C@@H]1CN(Cc2cc(C(c3ccc(C(C)=O)s3)C(C)C(=O)O)ccc2C)S(=O)(=O)c2cnccc2O1
|
C27H30N2O6S2 542.679000 |
SAOVNISQKFFRHT-IZUFBBGQSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM669907
|
Local ready
Direct docking supported
|
|
E3L033656
BDB033656
|
BDBM669908
CC[C@@H]1CN(Cc2cc(C(CC(=O)O)c3cccs3)ccc2C)S(=O)(=O)c2ccccc2O1
|
C25H27NO5S2 485.627000 |
QAAHCJFANWDTNJ-VQCQRNETSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM669908; PubChem:CID155466618
|
Local ready
Direct docking supported
|
|
E3L033657
BDB033657
|
BDBM669909
CC[C@@H]1CN(Cc2cc(C(CC(=O)O)c3ccc(S(N)(=O)=O)o3)ccc2C)S(=O)(=O)c2ccccc2O1
|
C25H28N2O8S2 548.639000 |
PBQHUZPNPJDVMK-FIWHBWSRSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM669909; PubChem:CID171902395
|
Local ready
Direct docking supported
|
|
E3L033658
BDB033658
|
BDBM669910
CC[C@@H]1CN(Cc2cc(C(CC(=O)O)c3ccc(C#N)s3)ccc2C)S(=O)(=O)c2ccccc2O1
|
C26H26N2O5S2 510.637000 |
MNXHTSWNZIWRSS-PSDZMVHGSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM669910; PubChem:CID155466621
|
Local ready
Direct docking supported
|
|
E3L033659
BDB033659
|
BDBM669911
CC[C@@H]1CN(Cc2cc(C(CC(=O)O)c3ccc(C(=O)C4CC4)n3C)ccc2C)S(=O)(=O)c2ccccc2O1
|
C30H34N2O6S 550.677000 |
ZVYHYFYTQNTLPH-MIHMCVIASA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM669911
|
Local ready
Direct docking supported
|
|
E3L033660
BDB033660
|
BDBM669912
CC[C@@H]1CN(Cc2cc(C(CC(=O)O)c3ccc(C(=O)NC)s3)ccc2C)S(=O)(=O)c2ccccc2O1
|
C27H30N2O6S2 542.679000 |
BAIQJMIVWASOMX-VQCQRNETSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM669912
|
Local ready
Direct docking supported
|