| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L037501
BDB037501
|
BDBM742033
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N(C)[C@@H](C#N)CCN(C)C)nn(-c3ccccc3)c21
|
C36H35F4N7O3 689.714000 |
IZFXPHBKNCVDMZ-UNRZKBSHSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742033
|
Local ready
Direct docking supported
|
|
E3L037502
BDB037502
|
BDBM742034
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N(C)[C@H](C#N)CCN(C)C)nn(-c3ccccc3)c21
|
C36H35F4N7O3 689.714000 |
IZFXPHBKNCVDMZ-XEVVZDEMSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742034
|
Local ready
Direct docking supported
|
|
E3L037503
BDB037503
|
BDBM742035
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)C(c2ccc(F)cc2)c2c(C(=O)N(C)C(C)C#N)nn(C3CCOCC3)c21
|
C32H32F4N6O4 640.638000 |
AKDQORBAMAABPF-ZNZMXDNOSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742035
|
Local ready
Direct docking supported
|
|
E3L037504
BDB037504
|
BDBM742036
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(C)cc2)c2c(C(=O)N(C)C(C)C#N)nn(C3CC3)c21
|
C31H31F3N6O3 592.622000 |
PTPQOVFDGWDSJT-BOQFIEIISA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742036
|
Local ready
Direct docking supported
|
|
E3L037505
BDB037505
|
BDBM742037
CCCn1nc(C(=O)N(C)C(C)C#N)c2c1N(CC)C(=O)[C@@H](NC(=O)c1cccc(C(F)(F)F)c1)[C@H]2c1ccc(F)cc1
|
C30H30F4N6O3 598.601000 |
WYAXMFRHVHPZMR-TWWXXLKNSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742037
|
Local ready
Direct docking supported
|
|
E3L037506
BDB037506
|
BDBM742038
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N(C)[C@H](C#N)CCN3CCOCC3)nn(-c3ccccc3)c21
|
C38H37F4N7O4 731.751000 |
MNJLGLHXHWAWRR-GCRSFRQPSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742038
|
Local ready
Direct docking supported
|
|
E3L037507
BDB037507
|
BDBM742039
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N(C)[C@@H](C#N)CCN3CCOCC3)nn(-c3ccccc3)c21
|
C38H37F4N7O4 731.751000 |
MNJLGLHXHWAWRR-JNGVYSEMSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742039
|
Local ready
Direct docking supported
|
|
E3L037508
BDB037508
|
BDBM742040
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N(C)[C@H](C#N)CCN(C)C3COC3)nn(-c3ccccc3)c21
|
C38H37F4N7O4 731.751000 |
OIYRENBJLMCLTN-LVCXIWIQSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742040
|
Local ready
Direct docking supported
|
|
E3L037509
BDB037509
|
BDBM742041
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N(C)[C@@H](C#N)CCN(C)C3COC3)nn(-c3ccccc3)c21
|
C38H37F4N7O4 731.751000 |
OIYRENBJLMCLTN-YUJJRVTMSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742041
|
Local ready
Direct docking supported
|
|
E3L037510
BDB037510
|
BDBM742042
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N(C)[C@H](C#N)CCN3CC4CC(C3)O4)nn(-c3ccccc3)c21
|
C39H37F4N7O4 743.762000 |
VUFZOIBUZQUTLT-RFQUHBHKSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742042
|
Local ready
Direct docking supported
|
|
E3L037511
BDB037511
|
BDBM742043
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N(C)[C@@H](C#N)CCN3CC4CC(C3)O4)nn(-c3ccccc3)c21
|
C39H37F4N7O4 743.762000 |
VUFZOIBUZQUTLT-OSMGSDQBSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742043
|
Local ready
Direct docking supported
|
|
E3L037512
BDB037512
|
BDBM742044
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N(C)[C@H](C#N)CCN3CCC34COC4)nn(-c3ccccc3)c21
|
C39H37F4N7O4 743.762000 |
LQVCIJIOSHNVCW-GCRSFRQPSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742044
|
Local ready
Direct docking supported
|
|
E3L037513
BDB037513
|
BDBM742045
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N(C)[C@@H](C#N)CCN3CCC34COC4)nn(-c3ccccc3)c21
|
C39H37F4N7O4 743.762000 |
LQVCIJIOSHNVCW-JNGVYSEMSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742045
|
Local ready
Direct docking supported
|
|
E3L037514
BDB037514
|
BDBM742046
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N(C)[C@H](C#N)CCN3CCN(C4COC4)CC3)nn(-c3ccccc3)c21
|
C41H42F4N8O4 786.831000 |
DPKSRAXTVGRFBJ-YXSDWHQUSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742046
|
Local ready
Direct docking supported
|
|
E3L037515
BDB037515
|
BDBM742047
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N(C)[C@@H](C#N)CCN3CCN(C4COC4)CC3)nn(-c3ccccc3)c21
|
C41H42F4N8O4 786.831000 |
DPKSRAXTVGRFBJ-OCVBKWNCSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742047
|
Local ready
Direct docking supported
|
|
E3L037516
BDB037516
|
BDBM742048
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N(C)[C@H](C#N)CCN3CC4CCC(C3)O4)nn(-c3ccccc3)c21
|
C40H39F4N7O4 757.789000 |
IQNKFFYOLXMRRP-HWWRMQEJSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742048
|
Local ready
Direct docking supported
|
|
E3L037517
BDB037517
|
BDBM742049
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N(C)[C@@H](C#N)CCN3CC4CCC(C3)O4)nn(-c3ccccc3)c21
|
C40H39F4N7O4 757.789000 |
IQNKFFYOLXMRRP-BZDJXQFZSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742049
|
Local ready
Direct docking supported
|
|
E3L037518
BDB037518
|
BDBM742050
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N(CC#N)CCN3CCOCC3)nn(-c3ccccc3)c21
|
C37H35F4N7O4 717.724000 |
VWJDYFUDUNINOO-SMCANUKXSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742050
|
Local ready
Direct docking supported
|
|
E3L037519
BDB037519
|
BDBM742051
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N(CC#N)CCN(C)C3COC3)nn(-c3ccccc3)c21
|
C37H35F4N7O4 717.724000 |
SFUACVRYHNCAAG-SMCANUKXSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742051
|
Local ready
Direct docking supported
|
|
E3L037520
BDB037520
|
BDBM742052
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N(CC#N)CCN3CC4CC(C3)O4)nn(-c3ccccc3)c21
|
C38H35F4N7O4 729.735000 |
FOFOEQXYPNHTRX-BRZPHXDTSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742052
|
Local ready
Direct docking supported
|