| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L037741
BDB037741
|
BDBM742273
CCN1C(=O)[C@@H](NC(=O)CCN2C(=O)COc3ccccc32)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C34H39N7O6 641.729000 |
XXJJAZTXAWZZQN-KPDGGNIRSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742273
|
Local ready
Direct docking supported
|
|
E3L037742
BDB037742
|
BDBM742274
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-ILBGXUMGSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742274; PubChem:CID176734007
|
Local ready
Direct docking supported
|
|
E3L037743
BDB037743
|
BDBM742275
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(C3CC3)c21
|
C31H28F4N6O3 608.596000 |
AVMGWHDHVICJDT-JBRSBNLGSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742275
|
Local ready
Direct docking supported
|
|
E3L037744
BDB037744
|
BDBM742276
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CCCC2)c2c(C(=O)N(C)[C@@H](C)C#N)nn(C3CCOCC3)c21
|
C31H37F3N6O4 614.669000 |
OBYPCJJPQMROCF-WYRQLCSISA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742276
|
Local ready
Direct docking supported
|
|
E3L037745
BDB037745
|
BDBM742277
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-FUDKSRODSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742277
|
Local ready
Direct docking supported
|
|
E3L037746
BDB037746
|
BDBM742278
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N3CC[C@H]3C#N)nn(-c3ccccc3)c21
|
C30H27F3N6O3 576.579000 |
BOUYCPUNINGGGZ-FIXSFTCYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742278; PubChem:CID176734011
|
Local ready
Direct docking supported
|
|
E3L037747
BDB037747
|
BDBM742279
CCN1C(=O)[C@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn([C@@H]3CCOC3)c21
|
C33H30F4N6O4 650.633000 |
OREQYUODEAONAK-UVNKEFLNSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742279
|
Local ready
Direct docking supported
|
|
E3L037748
BDB037748
|
BDBM742280
CCN1C(=O)[C@@H](NC(=O)c2ccc3cn[nH]c3c2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C31H34N8O4 582.665000 |
NBIQWJVAGNXUTQ-ZCQCUXIGSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742280
|
Local ready
Direct docking supported
|
|
E3L037749
BDB037749
|
BDBM742281
CCN1C(=O)[C@@H](NC(=O)c2ccc3ncoc3c2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C31H33N7O5 583.649000 |
OJMCZNBBABUMCZ-UOWHQYPDSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742281
|
Local ready
Direct docking supported
|
|
E3L037750
BDB037750
|
BDBM742282
CCN1C(=O)[C@@H](NC(=O)c2cccc3ncoc23)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C31H33N7O5 583.649000 |
VGJYUZGDSPIXNE-TZGDUONMSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742282
|
Local ready
Direct docking supported
|
|
E3L037751
BDB037751
|
BDBM742283
CCN1C(=O)[C@@H](NC(=O)[C@H]2C[C@@H]3CCCC[C@@H]3N2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C32H43N7O4 589.741000 |
YNTQQKICGNSNQB-BYRLSIGESA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742283
|
Local ready
Direct docking supported
|
|
E3L037752
BDB037752
|
BDBM742284
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c([C@@H](CCO)NC#N)nn(-c3ccccc3)c21
|
C32H28F4N6O3 620.607000 |
JDFBICDDEPBNQF-QQNWGBJXSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742284
|
Local ready
Direct docking supported
|
|
E3L037753
BDB037753
|
BDBM742285
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]2C1CC1
|
C27H31F3N6O3 544.578000 |
PDXXPIGVEDTRLD-XHRKEWCOSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742285; PubChem:CID176734017
|
Local ready
Direct docking supported
|
|
E3L037754
BDB037754
|
BDBM742286
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N3CC[C@@H]3C#N)nn(-c3ccccc3)c21
|
C33H26F4N6O3 630.602000 |
REMVZQXSUCEBHI-OBDYRVMHSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742286; PubChem:CID176734018
|
Local ready
Direct docking supported
|
|
E3L037755
BDB037755
|
BDBM742287
CCCn1nc(C(=O)N2CCC[C@H]2C#N)c2c1N(CC)C(=O)[C@H](NC(=O)c1cccc(C(F)(F)F)c1)[C@@H]2C1CC1
|
C28H31F3N6O3 556.589000 |
FUXZPSNCYMVNOL-TUNNFDKTSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742287; PubChem:CID176734019
|
Local ready
Direct docking supported
|
|
E3L037756
BDB037756
|
BDBM742288
CCCn1nc(C(=O)N(CC#N)C2CC2)c2c1N(CC)C(=O)[C@H](NC(=O)c1cccc(C(F)(F)F)c1)[C@@H]2c1ccc(F)cc1
|
C31H30F4N6O3 610.612000 |
SCJKBKRLDMUTKC-ILBGXUMGSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742288
|
Local ready
Direct docking supported
|
|
E3L037757
BDB037757
|
BDBM742289
C=C(CN1C2COCC1C2)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 |
ZESLEFHOGBZSEK-BHCZKVFGSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742289
|
Local ready
Direct docking supported
|
|
E3L037758
BDB037758
|
BDBM742290
C=C(CN(C)CC1COC1)C(=O)NCc1nn(-c2ccccc2)c2c1[C@H](c1ccc(F)cc1)[C@H](NC(=O)c1cccc(C(F)(F)F)c1)C(=O)N2CC
|
C38H38F4N6O4 718.752000 |
NMNPTGKCXSRYLU-WEZIJMHWSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742290
|
Local ready
Direct docking supported
|
|
E3L037759
BDB037759
|
BDBM742291
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c([C@H](CCO)NC#N)nn(-c3ccccc3)c21
|
C32H28F4N6O3 620.607000 |
JDFBICDDEPBNQF-VBOOUTDYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742291
|
Local ready
Direct docking supported
|
|
E3L037760
BDB037760
|
BDBM742292
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(CN(C#N)CCCN3CC4(COC4)C3)nn(-c3ccccc3)c21
|
C38H37F4N7O3 715.752000 |
NTPJCMJLSKWONG-WEZIJMHWSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742292
|
Local ready
Direct docking supported
|