| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L037781
BDB037781
|
BDBM742313
CCN1C(=O)[C@@H](NC(=O)c2ccc3c(c2)COC3)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C32H36N6O5 584.677000 |
DMCINPAABSRAMA-GHVDBIBNSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742313
|
Local ready
Direct docking supported
|
|
E3L037782
BDB037782
|
BDBM742314
CCN1C(=O)[C@@H](NC(=O)c2ccc3ocnc3c2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C31H33N7O5 583.649000 |
DQFNCGZZZGPDEP-UOWHQYPDSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742314
|
Local ready
Direct docking supported
|
|
E3L037783
BDB037783
|
BDBM742315
CCN1C(=O)[C@@H](NC(=O)c2cccc3[nH]ncc23)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C31H34N8O4 582.665000 |
QSGPLIDFUQLBAE-CZKPARTHSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742315
|
Local ready
Direct docking supported
|
|
E3L037784
BDB037784
|
BDBM742316
CCN1C(=O)[C@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)c2c(C(=O)N(CC#N)C3COC3)nn(-c3ccccc3)c21
|
C34H28F4N6O4 660.628000 |
CFSQUQZPEXHOPN-IXCJQBJRSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742316
|
Local ready
Direct docking supported
|
|
E3L037785
BDB037785
|
BDBM742317
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(CN(C)C/C=C/C(=O)OC(C)(C)C)nn(-c3ccccc3)c21
|
C38H39F4N5O4 705.753000 |
ARZQQZQFRSCOBI-FHIJNJGKSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742317
|
Local ready
Direct docking supported
|
|
E3L037786
BDB037786
|
BDBM742318
C=CC(=O)N[C@H](C)c1nn(-c2ccccc2)c2c1[C@H](c1ccc(F)cc1)[C@@H](NC(=O)c1nccc(C(F)(F)F)n1)C(=O)N2CC
|
C31H27F4N7O3 621.595000 |
QLXYAEZIJCBRCG-WVTMANGGSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742318
|
Local ready
Direct docking supported
|
|
E3L037787
BDB037787
|
BDBM742319
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(CN(C)C/C=C/C(=O)N3CCCC3)nn(-c3ccccc3)c21
|
C38H38F4N6O3 702.753000 |
MHYCUJOEFKJKMD-VLACESMBSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742319
|
Local ready
Direct docking supported
|
|
E3L037788
BDB037788
|
BDBM742320
CCN1C(=O)[C@@H](NC(=O)c2nccc(C(F)(F)F)n2)[C@H](c2ccc(F)cc2)c2c(CC(=O)N[C@H](C)C#N)nn(-c3ccccc3)c21
|
C31H26F4N8O3 634.594000 |
OJRKRKXKBCFZQB-OQRIRGNISA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742320
|
Local ready
Direct docking supported
|
|
E3L037789
BDB037789
|
BDBM742321
CCN1C(=O)[C@@](CO)(NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c([C@@H](C)NC#N)nn(-c3ccccc3)c21
|
C32H28F4N6O3 620.607000 |
MOBJIPYNMAKNJV-JSXXVDJESA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742321; PubChem:CID176734048
|
Local ready
Direct docking supported
|
|
E3L037790
BDB037790
|
BDBM742322
CCN1C(=O)[C@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c([C@@H](C)N(C#N)CCCN(C)C)nn(-c3ccccc3)c21
|
C36H37F4N7O2 675.731000 |
UWEMQJFFSFJJCC-IEHNKUDYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742322
|
Local ready
Direct docking supported
|
|
E3L037791
BDB037791
|
BDBM742323
CCN1C(=O)[C@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)c2c(C(=O)N3CCC[C@H]3C#N)nn(-c3ccccc3)c21
|
C34H28F4N6O3 644.629000 |
QIMLQCSCUMNNBK-ZRRKCSAHSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742323; PubChem:CID176734049
|
Local ready
Direct docking supported
|
|
E3L037792
BDB037792
|
BDBM742324
C=C(CN1CCCC1)C(=O)NCc1nn(-c2ccccc2)c2c1[C@H](c1ccc(F)cc1)[C@H](NC(=O)c1cccc(C(F)(F)F)c1)C(=O)N2CC
|
C37H36F4N6O3 688.726000 |
LOHMTOXFYRZWDM-CDZUIXILSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742324
|
Local ready
Direct docking supported
|
|
E3L037793
BDB037793
|
BDBM742325
C=C(CN1C2CCC1COC2)C(=O)NCc1nn(-c2ccccc2)c2c1[C@H](c1ccc(F)cc1)[C@H](NC(=O)c1cccc(C(F)(F)F)c1)C(=O)N2CC
|
C39H38F4N6O4 730.763000 |
YDQNHDWGGCFHBS-OGYKNADMSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742325
|
Local ready
Direct docking supported
|
|
E3L037794
BDB037794
|
BDBM742326
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(CN(C#N)CCCN3CCN(C4COC4)CC3)nn(-c3ccccc3)c21
|
C40H42F4N8O3 758.821000 |
NVQIEJOWAZYOIC-GIWKVKTRSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742326
|
Local ready
Direct docking supported
|
|
E3L037795
BDB037795
|
BDBM742327
CCN1C(=O)[C@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)c2c(C(=O)N3CCC[C@H]3C#N)nn(-c3cccc(OCCCN4CC5(COC5)C4)c3)c21
|
C42H41F4N7O5 799.826000 |
JOUVLEOCYLPWTF-LWKLBADKSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742327
|
Local ready
Direct docking supported
|
|
E3L037796
BDB037796
|
BDBM742328
CCN1C(=O)[C@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)c2c(C(=O)N3CCC[C@H]3C#N)nn(-c3cccc(OCCN4CCC5(CC4)COC5)c3)c21
|
C43H43F4N7O5 813.853000 |
HNKRYPNJKXBKQM-DELQJEEYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742328
|
Local ready
Direct docking supported
|
|
E3L037797
BDB037797
|
BDBM742329
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N3CS(=O)(=O)C[C@H]3C#N)nn(C3CCOCC3)c21
|
C29H31F3N6O6S 648.664000 |
PWJRGJSBCUHSBG-GIWBLDEGSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742329
|
Local ready
Direct docking supported
|
|
E3L037798
BDB037798
|
BDBM742330
CCN1C(=O)[C@@H](NC(=O)CC2CC(=O)c3ccc(OC)cc32)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C35H40N6O6 640.741000 |
MLPOYHINSDKMNP-QJHRPVOZSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742330
|
Local ready
Direct docking supported
|
|
E3L037799
BDB037799
|
BDBM742331
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N(CC#N)C3CC3)nn(-c3ccccc3)c21
|
C31H29F3N6O3 590.606000 |
BPDPPQCWBBZIHU-ZCYQVOJMSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742331; PubChem:CID176734057
|
Local ready
Direct docking supported
|
|
E3L037800
BDB037800
|
BDBM742332
CCOc1ccc(C)c(C(=O)N[C@@H]2C(=O)N(CC)c3c(c(C(=O)N4[C@H](C#N)C[C@H]5C[C@H]54)nn3C3CCOCC3)[C@@H]2C2CC2)c1
|
C33H40N6O5 600.720000 |
QUQUNDUUZZOOQI-UQEWXXAASA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742332
|
Local ready
Direct docking supported
|