| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L037661
BDB037661
|
BDBM742193
CCN1C(=O)[C@@H](CC(=O)CC2CC2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C29H37N5O4 519.646000 |
VAHSWHZSSDSQIQ-UPNQLTQGSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742193
|
Local ready
Direct docking supported
|
|
E3L037662
BDB037662
|
BDBM742194
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-ONTIZHBOSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742194; PubChem:CID176733934
|
Local ready
Direct docking supported
|
|
E3L037663
BDB037663
|
BDBM742195
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2C)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C32H35F3N6O4 624.664000 |
CJVVUMGFKHMCSG-PCUMXSHXSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742195
|
Local ready
Direct docking supported
|
|
E3L037664
BDB037664
|
BDBM742196
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CCCC2)c2c(C(=O)N3CCC[C@H]3C#N)nn(C3CCOCC3)c21
|
C32H37F3N6O4 626.680000 |
GXCHMVVCAWNIOE-GNKBHMEESA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742196; PubChem:CID176733936
|
Local ready
Direct docking supported
|
|
E3L037665
BDB037665
|
BDBM742197
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-JLHXZSQLSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742197
|
Local ready
Direct docking supported
|
|
E3L037666
BDB037666
|
BDBM742198
CCN1C(=O)[C@@H](NC(=O)c2sc(NC(C)=O)nc2C)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C30H36N8O5S 620.736000 |
CGRSFCPKOHKDLI-BYGOBXPBSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742198
|
Local ready
Direct docking supported
|
|
E3L037667
BDB037667
|
BDBM742199
CCN1C(=O)[C@@H](NC(=O)c2ccn(C(C)C)n2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C30H38N8O4 574.686000 |
IJAOLOQHPIEIPW-IMZPRDNVSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742199
|
Local ready
Direct docking supported
|
|
E3L037668
BDB037668
|
BDBM742200
CCN1C(=O)[C@@H](NC(=O)c2c(Cl)cccc2Cl)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C30H32Cl2N6O4 611.530000 |
OPFRFGJIUCHCDM-GBHKDPRZSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742200
|
Local ready
Direct docking supported
|
|
E3L037669
BDB037669
|
BDBM742201
COCCN1C(=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
|
C32H35F3N6O5 640.663000 |
GBHMNCSXJYWKFU-JTIVYOABSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742201
|
Local ready
Direct docking supported
|
|
E3L037670
BDB037670
|
BDBM742202
CCN1C(=O)[C@@H](NC(=O)c2cc(S(C)(=O)=O)ccc2F)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C31H35FN6O6S 638.722000 |
GLPVQWFAQIBYIN-CZKPARTHSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742202
|
Local ready
Direct docking supported
|
|
E3L037671
BDB037671
|
BDBM742203
CCN1C(=O)[C@@H](NC(=O)CCc2ccccc2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C32H38N6O4 570.694000 |
JTONQVJRRKGVRJ-BIYTYRGCSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742203
|
Local ready
Direct docking supported
|
|
E3L037672
BDB037672
|
BDBM742204
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CCCC2)c2c(C(=O)N(CC#N)C3CC3)nn(C3CCOCC3)c21
|
C32H37F3N6O4 626.680000 |
VWTWHGPIMRYADB-AHWVRZQESA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742204
|
Local ready
Direct docking supported
|
|
E3L037673
BDB037673
|
BDBM742205
CCCn1nc(C(=O)N2CCC[C@H]2C#N)c2c1N(CC)C(=O)[C@H](NC(=O)c1cccc(C(F)(F)F)c1)[C@@H]2c1ccc(F)cc1
|
C31H30F4N6O3 610.612000 |
PMBQIGQJUSQZFZ-JBRSBNLGSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742205; PubChem:CID176733945
|
Local ready
Direct docking supported
|
|
E3L037674
BDB037674
|
BDBM742206
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(OCCCN(C)C4COC4)c3)c21
|
C41H41F4N7O5 787.815000 |
ITPDXFSDJPHXCK-KZDQMGDASA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742206
|
Local ready
Direct docking supported
|
|
E3L037675
BDB037675
|
BDBM742207
CCN1C(=O)[C@@H](NC(=O)c2csc(C)c2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C29H34N6O4S 562.696000 |
SCHQOJMNXLULST-JHXDLCHDSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742207
|
Local ready
Direct docking supported
|
|
E3L037676
BDB037676
|
BDBM742208
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-SUQNHEHSSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742208
|
Local ready
Direct docking supported
|
|
E3L037677
BDB037677
|
BDBM742209
CCN1C(=O)[C@@H](NC(=O)c2ccc3scnc3c2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C31H33N7O4S 599.717000 |
OCIFEAHSTLQOGN-UOWHQYPDSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742209
|
Local ready
Direct docking supported
|
|
E3L037678
BDB037678
|
BDBM742210
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(CN(C#N)CCN(C)C)nn(-c3ccccc3)c21
|
C34H33F4N7O2 647.677000 |
LRYVLEAYXJTFJA-JDXGNMNLSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742210
|
Local ready
Direct docking supported
|
|
E3L037679
BDB037679
|
BDBM742211
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c([C@@H](CO)NC#N)nn(-c3ccccc3)c21
|
C31H26F4N6O3 606.580000 |
GYRGFTCDYTUSAW-DXBVXKBHSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742211; PubChem:CID176733950
|
Local ready
Direct docking supported
|
|
E3L037680
BDB037680
|
BDBM742212
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(NC(=O)C3=CCCN(C)C3)nn(-c3ccccc3)c21
|
C35H32F4N6O3 660.672000 |
LHHOCIANKNEYAV-YTMVLYRLSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742212
|
Local ready
Direct docking supported
|