| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L037821
BDB037821
|
BDBM742353
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)c2c(CNC(=O)C(C)C#N)nn(-c3ccccc3)c21
|
C33H28F4N6O3 632.618000 |
VKOAIWZAZHAFAU-OGGJSMKJSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742353; PubChem:CID176734073
|
Local ready
Direct docking supported
|
|
E3L037822
BDB037822
|
BDBM742354
CCN1C(=O)[C@H](NC(=O)c2cccc(C(F)(F)F)c2)C(C2CC2)c2c(C(=O)N3CCC[C@H]3C#N)nn(-c3ccccc3)c21
|
C31H29F3N6O3 590.606000 |
PMFGCPFIXSDLBF-OPEVTLNRSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742354; PubChem:CID176734074
|
Local ready
Direct docking supported
|
|
E3L037823
BDB037823
|
BDBM742355
C=C(CN1CC(C)(O)C1)C(=O)NCc1nn(-c2ccccc2)c2c1[C@H](c1ccc(F)cc1)[C@H](NC(=O)c1cccc(C(F)(F)F)c1)C(=O)N2CC
|
C37H36F4N6O4 704.725000 |
JWLFYFPAQKCMGZ-SMCANUKXSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742355
|
Local ready
Direct docking supported
|
|
E3L037824
BDB037824
|
BDBM742356
C=C(CN1CCC12COC2)C(=O)NCc1nn(-c2ccccc2)c2c1[C@H](c1ccc(F)cc1)[C@H](NC(=O)c1cccc(C(F)(F)F)c1)C(=O)N2CC
|
C38H36F4N6O4 716.736000 |
SYAURTOUURRRSB-CDZUIXILSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742356
|
Local ready
Direct docking supported
|
|
E3L037825
BDB037825
|
BDBM742357
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(CN(C#N)CCCN(C)C3COC3)nn(-c3ccccc3)c21
|
C37H37F4N7O3 703.741000 |
DCERYPUUZOZIMV-WEZIJMHWSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742357
|
Local ready
Direct docking supported
|
|
E3L037826
BDB037826
|
BDBM742358
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(OCCN4CC5(COC5)C4)c3)c21
|
C41H39F4N7O5 785.799000 |
TYHQFKXFPPLJDO-DEIXXNFJSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742358
|
Local ready
Direct docking supported
|
|
E3L037827
BDB037827
|
BDBM742359
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(OCCN4CCN(C5COC5)CC4)c3)c21
|
C43H44F4N8O5 828.868000 |
CBVIRYIWOBGKSJ-FFLCEETJSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742359
|
Local ready
Direct docking supported
|
|
E3L037828
BDB037828
|
BDBM742360
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(C)=O)nn(-c3ccccc3)c21
|
C30H24F4N4O3 564.539000 |
NXXBCGGLRFIKHY-OZXSUGGESA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742360; PubChem:CID176734080
|
Local ready
Direct docking supported
|
|
E3L037829
BDB037829
|
BDBM742361
CN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C30H31F3N6O4 596.610000 |
MBNFTYFGADKTMT-JHXDLCHDSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742361
|
Local ready
Direct docking supported
|
|
E3L037830
BDB037830
|
BDBM742362
CCN1C(=O)[C@@H](NC(=O)C2CCC(F)(F)CC2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C30H38F2N6O4 584.668000 |
MNGRUJXZJVKGMW-AXMVRHARSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742362
|
Local ready
Direct docking supported
|
|
E3L037831
BDB037831
|
BDBM742363
CCN1C(=O)[C@@H](NC(=O)c2ccc(C3CCN(C)CC3)cc2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C36H45N7O4 639.801000 |
CUEGMAPMFONQEM-OTIYIZTNSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742363
|
Local ready
Direct docking supported
|
|
E3L037832
BDB037832
|
BDBM742364
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(C3CCOCC3)c21
|
C37H41F4N7O5 739.771000 |
PROPCKOIVDMNBU-QKMMQOFESA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742364
|
Local ready
Direct docking supported
|
|
E3L037833
BDB037833
|
BDBM742365
CCN1C(=O)[C@@H](NC(=O)C2CC(C)C2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C29H38N6O4 534.661000 |
CJHZUFVZHCPUIW-GEOLRAHJSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742365
|
Local ready
Direct docking supported
|
|
E3L037834
BDB037834
|
BDBM742366
CCN1C(=O)[C@@H](NC(=O)c2csc3c2CCC(C)C3)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C33H40N6O4S 616.788000 |
PVZRZEHTIPWJAX-RDESXPQCSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742366
|
Local ready
Direct docking supported
|
|
E3L037835
BDB037835
|
BDBM742367
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N3CCOC[C@@H]3C#N)nn(-c3ccccc3)c21
|
C31H29F3N6O4 606.605000 |
ZOSAHQMPIMEYTG-LSQMVHIFSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742367; PubChem:CID176734087
|
Local ready
Direct docking supported
|
|
E3L037836
BDB037836
|
BDBM742368
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N3CCS(=O)(=O)C[C@H]3C#N)nn(-c3ccccc3)c21
|
C31H29F3N6O5S 654.671000 |
WOWUNIHBHBNHED-CUYJMHBOSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742368
|
Local ready
Direct docking supported
|
|
E3L037837
BDB037837
|
BDBM742369
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N3CC[C@H]3C#N)nn(C3CCOCC3)c21
|
C29H31F3N6O4 584.599000 |
GFPAHWLHEPUJJI-FUDKSRODSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742369; PubChem:CID176734088
|
Local ready
Direct docking supported
|
|
E3L037838
BDB037838
|
BDBM742370
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N3CS(=O)(=O)C[C@H]3C#N)nn(C3CCOCC3)c21
|
C32H30F4N6O6S 702.687000 |
OEQBVFSUSSOPQZ-USZFVNFHSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742370
|
Local ready
Direct docking supported
|
|
E3L037839
BDB037839
|
BDBM742371
CCN1C(=O)[C@@H](NC(=O)C23CC(C(F)F)(C2)C3)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C30H36F2N6O4 582.652000 |
VCKWJHJLNPOROZ-HOWXQJNCSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742371
|
Local ready
Direct docking supported
|
|
E3L037840
BDB037840
|
BDBM742372
CCN1C(=O)[C@@H](NC(=O)CC2CCCc3ccccc32)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C35H42N6O4 610.759000 |
NHSPZWRVBZVXFH-ZKBINKHXSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742372
|
Local ready
Direct docking supported
|