| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L037681
BDB037681
|
BDBM742213
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c([C@H](CCCO)NC#N)nn(-c3ccccc3)c21
|
C33H30F4N6O3 634.634000 |
BDKPFESXLGAMDE-ZEZDXWPOSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742213; PubChem:CID176733952
|
Local ready
Direct docking supported
|
|
E3L037682
BDB037682
|
BDBM742214
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(CNC/C=C/C(=O)N(C)C)nn(-c3ccccc3)c21
|
C35H34F4N6O3 662.688000 |
JHXMKTPVKDIQPH-SXVQUNNTSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742214
|
Local ready
Direct docking supported
|
|
E3L037683
BDB037683
|
BDBM742215
C=C(CN(C)C1COC1)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 |
YWQVTEFXBYHGHX-BHYZAODMSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742215
|
Local ready
Direct docking supported
|
|
E3L037684
BDB037684
|
BDBM742216
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N(C)C(C)C#N)nn(C3CC3)c21
|
C27H29F3N6O3 542.562000 |
AEBXOXCHVVVZHE-CHOYDLAGSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742216; PubChem:CID176733955
|
Local ready
Direct docking supported
|
|
E3L037685
BDB037685
|
BDBM742217
CCN1C(=O)[C@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H](c2ccc(C)cc2)c2c(C(=O)N(C)CC#N)nn(C3CC3)c21
|
C30H29F3N6O3 578.595000 |
XWEGMUKXMHXNDD-ISKFKSNPSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742217
|
Local ready
Direct docking supported
|
|
E3L037686
BDB037686
|
BDBM742218
CCN1C(=O)[C@@H](NC(=O)c2nccc(C(F)(F)F)n2)[C@H](c2ccc(F)cc2)c2c(CNC(=O)/C=C/C(=O)N3CCCC3)nn(-c3ccccc3)c21
|
C35H32F4N8O4 704.685000 |
MOUVEIIHETWVJM-JHLBBIGVSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742218
|
Local ready
Direct docking supported
|
|
E3L037687
BDB037687
|
BDBM742219
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(CN(C#N)CCCN3CCOCC3)nn(-c3ccccc3)c21
|
C37H37F4N7O3 703.741000 |
HBZCELICNMTXAV-WEZIJMHWSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742219
|
Local ready
Direct docking supported
|
|
E3L037688
BDB037688
|
BDBM742220
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c([C@@H](CCC(O)CO)NC#N)nn(-c3ccccc3)c21
|
C34H32F4N6O4 664.660000 |
XGPNGRPAGPJMTR-OMUHOPHFSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742220
|
Local ready
Direct docking supported
|
|
E3L037689
BDB037689
|
BDBM742221
C[C@@H](NC#N)c1nn(-c2ccccc2)c2c1[C@@H](c1ccc(F)cc1)[C@@H](NC(=O)c1cccc(C(F)(F)F)c1)C(=O)N2CCO
|
C31H26F4N6O3 606.580000 |
SBPVSAOMDQBNRT-AVDBILAHSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742221
|
Local ready
Direct docking supported
|
|
E3L037690
BDB037690
|
BDBM742222
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c([C@@H](C)NC(N)=O)nn(-c3ccccc3)c21
|
C31H28F4N6O3 608.596000 |
YVIXLVJYHZFSJW-NPTLNSMLSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742222; PubChem:CID176350904
|
Local ready
Direct docking supported
|
|
E3L037691
BDB037691
|
BDBM742223
CCN1C(=O)[C@@H](NC(=O)N2CCC[C@H](C(F)(F)F)C2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N3CCC[C@H]3C#N)nn(-c3ccccc3)c21
|
C33H33F4N7O3 651.665000 |
VQOCVYSONFZUPZ-DJESZUOASA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742223
|
Local ready
Direct docking supported
|
|
E3L037692
BDB037692
|
BDBM742224
CCN1C(=O)[C@@H](NC(=O)c2ccc(F)c(F)c2OC)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C31H34F2N6O5 608.646000 |
WVBHYUYONUSYDQ-GBHKDPRZSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742224
|
Local ready
Direct docking supported
|
|
E3L037693
BDB037693
|
BDBM742225
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N3CC(NC)C[C@H]3C#N)nn(C3CCOCC3)c21
|
C31H36F3N7O4 627.668000 |
ORBTZLRNLJPZPO-XZGUZTHGSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742225
|
Local ready
Direct docking supported
|
|
E3L037694
BDB037694
|
BDBM742226
CCN1C(=O)[C@@H](NC(=O)CC2=C(C)Cc3ccc(F)cc32)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C35H39FN6O4 626.733000 |
FBSJHPPFJLPDNZ-PTNYGQAISA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742226
|
Local ready
Direct docking supported
|
|
E3L037695
BDB037695
|
BDBM742227
CCN1C(=O)[C@@H](NC(=O)c2cccc(N3CCCC3=O)c2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C34H39N7O5 625.730000 |
OBVZIBRSRIWCPW-PQGUPMRESA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742227
|
Local ready
Direct docking supported
|
|
E3L037696
BDB037696
|
BDBM742228
CCN1C(=O)[C@@H](NC(=O)c2cnc(C)cc2Cl)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C30H34ClN7O4 592.100000 |
ZPCVFELFTCEMHJ-TZGDUONMSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742228
|
Local ready
Direct docking supported
|
|
E3L037697
BDB037697
|
BDBM742229
CCN1C(=O)[C@@H](NC(=O)c2cnn(CC(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
|
C29H33F3N8O4 614.629000 |
WKPBPNNTMJUOSY-QRDGOAKLSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742229
|
Local ready
Direct docking supported
|
|
E3L037698
BDB037698
|
BDBM742230
CCN1C(=O)[C@@H](NC(=O)c2ccc(C3CC3)cc2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C33H38N6O4 582.705000 |
OKWSAVGDVSXESI-NPNDYVEYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742230
|
Local ready
Direct docking supported
|
|
E3L037699
BDB037699
|
BDBM742231
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N3C[C@H](NC)C[C@H]3C#N)nn(C3CCOCC3)c21
|
C34H35F4N7O4 681.691000 |
YKIONAYQNSGEEW-XAUNCYBDSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742231
|
Local ready
Direct docking supported
|
|
E3L037700
BDB037700
|
BDBM742232
CCN1C(=O)[C@@H](NC(=O)CN2C(=O)CSc3ccccc32)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C33H37N7O5S 643.770000 |
PMAOZJIRPRPWAC-SKKKVIBTSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742232
|
Local ready
Direct docking supported
|