| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L060181
BDB060181
|
BDBM50547089
COc1cccc(C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)N2CCc3c2cccc3N(CC(=O)NS(=O)(=O)c2ccccc2)S(=O)(=O)c2ccc(C)cc2)c1
|
C40H40N4O10S3 832.979000 |
PYMHFYSNBABJNX-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50547089
|
Local ready
Direct docking supported
|
|
E3L060182
BDB060182
|
BDBM50547090
COc1cccc(C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)N2CCc3c2cccc3N(CC(=O)NS(=O)(=O)c2ccccc2)S(=O)(=O)c2ccc(F)cc2)c1
|
C39H37FN4O10S3 836.942000 |
AKBWUYRCSVJIHO-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50547090
|
Local ready
Direct docking supported
|
|
E3L060183
BDB060183
|
BDBM50547091
COc1cccc(C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)N2CCc3c2cccc3N(CC(=O)NS(=O)(=O)c2ccccc2)S(=O)(=O)c2ccc(NC(C)=O)cc2)c1
|
C41H41N5O11S3 876.004000 |
BGMAUKGKUMCNQN-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50547091
|
Local ready
Direct docking supported
|
|
E3L060184
BDB060184
|
BDBM50547092
COc1cccc(C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)N2CCc3c2cccc3N(CC(=O)NS(=O)(=O)c2ccccc2)S(=O)(=O)c2ccccc2OC)c1
|
C40H40N4O11S3 848.978000 |
GGMVLKKFNMHSQH-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50547092
|
Local ready
Direct docking supported
|
|
E3L060185
BDB060185
|
BDBM50547093
COc1cccc(C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)N2CCc3c2cccc3N(CC(=O)NS(=O)(=O)c2ccccc2)S(=O)(=O)c2cccc(OC)c2)c1
|
C40H40N4O11S3 848.978000 |
SZCFXWJVMWCTJU-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50547093
|
Local ready
Direct docking supported
|
|
E3L060186
BDB060186
|
BDBM50547094
COc1cccc(C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)N2CCc3c2cccc3N(CC(=O)NS(=O)(=O)c2ccccc2)S(=O)(=O)c2ccccc2)c1
|
C39H38N4O10S3 818.952000 |
LRYPXAMUKSYUSP-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB, PubChem
BindingDB:BDBM50547094; PubChem:CID162649191
|
Local ready
Direct docking supported
|
|
E3L060187
BDB060187
|
BDBM50547095
COc1ccc(S(=O)(=O)N(CC(=O)NS(=O)(=O)C2CC2)c2cccc3c2CCN3C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)c2cccc(OC)c2)cc1
|
C37H40N4O11S3 812.945000 |
YOBZXKWUCZLGPX-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50547095
|
Local ready
Direct docking supported
|
|
E3L060188
BDB060188
|
BDBM50547096
COc1ccc(S(=O)(=O)N(CC(=O)NS(C)(=O)=O)c2cccc3c2CCN3C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)c2cccc(OC)c2)cc1
|
C35H38N4O11S3 786.907000 |
QITSHWUVULBLPV-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50547096
|
Local ready
Direct docking supported
|
|
E3L060189
BDB060189
|
BDBM50547097
COc1ccc(S(=O)(=O)N(CC(=O)NS(=O)(=O)C(F)(F)F)c2cccc3c2CCN3C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)c2cccc(OC)c2)cc1
|
C35H35F3N4O11S3 840.877000 |
AQGKTVNMPFJOIN-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50547097
|
Local ready
Direct docking supported
|
|
E3L060190
BDB060190
|
BDBM50547098
COc1ccc(S(=O)(=O)N(CC(=O)NS(=O)(=O)c2cccnc2)c2cccc3c2CCN3C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)c2cccc(OC)c2)cc1
|
C39H39N5O11S3 849.966000 |
QGMVYQZGNKEWSS-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50547098
|
Local ready
Direct docking supported
|
|
E3L060191
BDB060191
|
BDBM50547099
COc1ccc(S(=O)(=O)N(CC(=O)NS(=O)(=O)c2cccs2)c2cccc3c2CCN3C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)c2cccc(OC)c2)cc1
|
C38H38N4O11S4 855.007000 |
VCOVRRCZLNJXTD-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50547099
|
Local ready
Direct docking supported
|
|
E3L060192
BDB060192
|
BDBM50547100
COc1ccc(S(=O)(=O)NC(=O)CN(c2cccc3c2CCN3C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)c2cccc(OC)c2)S(=O)(=O)c2ccc(OC)cc2)cc1
|
C41H42N4O12S3 879.004000 |
JTDWZQZKKFDOFM-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50547100
|
Local ready
Direct docking supported
|
|
E3L060193
BDB060193
|
BDBM50547101
COc1ccc(S(=O)(=O)N(CC(=O)NS(=O)(=O)c2ccc(C)cc2)c2cccc3c2CCN3C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)c2cccc(OC)c2)cc1
|
C41H42N4O11S3 863.005000 |
CKXPPUCCQVLHDB-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50547101
|
Local ready
Direct docking supported
|
|
E3L060194
BDB060194
|
BDBM50547102
COc1ccc(S(=O)(=O)N(CC(=O)NS(=O)(=O)c2ccc(F)cc2)c2cccc3c2CCN3C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)c2cccc(OC)c2)cc1
|
C40H39FN4O11S3 866.968000 |
OZAAXWVOTLOTBE-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50547102
|
Local ready
Direct docking supported
|
|
E3L060195
BDB060195
|
BDBM50547103
COc1ccc(S(=O)(=O)N(CC(=O)NS(=O)(=O)c2ccc(C(F)(F)F)cc2)c2cccc3c2CCN3C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)c2cccc(OC)c2)cc1
|
C41H39F3N4O11S3 916.975000 |
UJXAAHIAKKSSDU-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50547103
|
Local ready
Direct docking supported
|
|
E3L060196
BDB060196
|
BDBM50547104
CCc1ccc(S(=O)(=O)NC(=O)CN(c2cccc3c2CCN3C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)c2cccc(OC)c2)S(=O)(=O)c2ccc(OC)cc2)cc1
|
C42H44N4O11S3 877.032000 |
NUEHGCQLJBBRII-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50547104
|
Local ready
Direct docking supported
|
|
E3L060197
BDB060197
|
BDBM50547105
COc1ccc(S(=O)(=O)N(CC(=O)NS(=O)(=O)c2ccc(O)cc2)c2cccc3c2CCN3C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)c2cccc(OC)c2)cc1
|
C40H40N4O12S3 864.977000 |
LDSAYMNKDDHQGU-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50547105
|
Local ready
Direct docking supported
|
|
E3L060198
BDB060198
|
BDBM50547106
CCOc1ccc(S(=O)(=O)NC(=O)CN(c2cccc3c2CCN3C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)c2cccc(OC)c2)S(=O)(=O)c2ccc(OC)cc2)cc1
|
C42H44N4O12S3 893.031000 |
WJXZWHTUIPKIHD-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50547106
|
Local ready
Direct docking supported
|
|
E3L060199
BDB060199
|
BDBM50547107
COc1ccc(S(=O)(=O)N(CC(=O)NS(=O)(=O)c2ccccc2OC)c2cccc3c2CCN3C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)c2cccc(OC)c2)cc1
|
C41H42N4O12S3 879.004000 |
ORCZSBUMPOQEMA-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50547107
|
Local ready
Direct docking supported
|
|
E3L060200
BDB060200
|
BDBM50547108
COc1ccc(S(=O)(=O)N(CC(=O)NS(=O)(=O)c2cccc(OC)c2)c2cccc3c2CCN3C(C(=O)NS(=O)(=O)c2ccc(C)cc2OC)c2cccc(OC)c2)cc1
|
C41H42N4O12S3 879.004000 |
FJKDWINVPKYUEZ-UHFFFAOYSA-N | Q14145 | Kelch-like ECH-associated protein 1 |
BindingDB
BindingDB:BDBM50547108
|
Local ready
Direct docking supported
|