| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L037601
BDB037601
|
BDBM742133
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)c2c(CN(C)C(=O)CC#N)nn(-c3ccccc3)c21
|
C33H28F4N6O3 632.618000 |
HAAIKWWTUBRPOM-PXJZQJOASA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742133
|
Local ready
Direct docking supported
|
|
E3L037602
BDB037602
|
BDBM742134
CCN1C(=O)[C@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H](C2CC2)c2c(C(=O)N(CC#N)C3CC3)nn(C3CCOCC3)c21
|
C30H33F3N6O4 598.626000 |
BRAAUMHOAJASBX-ISKFKSNPSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742134; PubChem:CID176733878
|
Local ready
Direct docking supported
|
|
E3L037603
BDB037603
|
BDBM742135
CCN1C(=O)[C@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)c2c(C(=O)N(CC#N)CC(=O)OC)nn(-c3ccccc3)c21
|
C34H28F4N6O5 676.627000 |
GDDZXSDXDPIMPE-IXCJQBJRSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742135
|
Local ready
Direct docking supported
|
|
E3L037604
BDB037604
|
BDBM742136
C=C(CN1CC2(CCO2)C1)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 |
BPCMGTGDXXQCDA-CDZUIXILSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742136
|
Local ready
Direct docking supported
|
|
E3L037605
BDB037605
|
BDBM742137
CCN1C(=O)[C@@H](NC(=O)c2nccc(C(F)(F)F)n2)[C@@H](c2ccc(F)cc2)c2c(CNC(=O)/C=C/C(=O)OC(C)(C)C)nn(-c3ccccc3)c21
|
C35H33F4N7O5 707.685000 |
RPNQTUSDJLRACQ-KCTAOFFNSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742137
|
Local ready
Direct docking supported
|
|
E3L037606
BDB037606
|
BDBM742138
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cn2)c2c(C(=O)N3CCC[C@H]3C#N)nn(-c3ccccc3)c21
|
C33H27F4N7O3 645.617000 |
CHQQJBBDGDNVIW-RMDSEJHCSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742138
|
Local ready
Direct docking supported
|
|
E3L037607
BDB037607
|
BDBM742139
CCN1C(=O)[C@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)c2c([C@H](C)NC#N)nn(-c3ccccc3)c21
|
C31H26F4N6O2 590.581000 |
YQFLIGVZAKRBBT-WCTKDPGZSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742139; PubChem:CID176733883
|
Local ready
Direct docking supported
|
|
E3L037608
BDB037608
|
BDBM742140
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c([C@H](NC#N)C(F)F)nn(-c3ccccc3)c21
|
C31H24F6N6O2 626.561000 |
ZXMAMYPQODOTKI-HRNNMHKYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742140
|
Local ready
Direct docking supported
|
|
E3L037609
BDB037609
|
BDBM742141
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c([C@@H](C)NC#N)nn(C3CCOCC3)c21
|
C30H30F4N6O3 598.601000 |
BXRRDBAMOVTPDY-NPTLNSMLSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742141; PubChem:CID176733885
|
Local ready
Direct docking supported
|
|
E3L037610
BDB037610
|
BDBM742142
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccccn2)c2c(C(=O)N3CCC[C@H]3C#N)nn(-c3ccccc3)c21
|
C33H28F3N7O3 627.627000 |
ZNWHEPUQWVCIKH-RMDSEJHCSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742142; PubChem:CID176733886
|
Local ready
Direct docking supported
|
|
E3L037611
BDB037611
|
BDBM742143
CCN1C(=O)[C@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)c2c(C(=O)N(CC#N)C3CC3)nn(C3CCOCC3)c21
|
C33H32F4N6O4 652.649000 |
IOBLTZWFQVLBKG-XNMGPUDCSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742143
|
Local ready
Direct docking supported
|
|
E3L037612
BDB037612
|
BDBM742144
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(C3CCOCC3)c21
|
C29H33F3N6O4 586.615000 |
AOOYCWUTCINLBX-KDTADFBSSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742144
|
Local ready
Direct docking supported
|
|
E3L037613
BDB037613
|
BDBM742145
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N3[C@H](C)CC[C@H]3C#N)nn(C3CCOCC3)c21
|
C34H34F4N6O4 666.676000 |
BYSHPFUKGBRGQG-LLOSZVIFSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742145
|
Local ready
Direct docking supported
|
|
E3L037614
BDB037614
|
BDBM742146
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(CN(C)CC#N)nn(-c3ccccc3)c21
|
C32H28F4N6O2 604.608000 |
IQPLYHPFXGWMOF-XCZPVHLTSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742146; PubChem:CID176733890
|
Local ready
Direct docking supported
|
|
E3L037615
BDB037615
|
BDBM742147
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N3CC[C@H](OC)[C@H]3C#N)nn(C3CCOCC3)c21
|
C31H35F3N6O5 628.652000 |
OAHKCWCHXRAUIL-FVEXOFTDSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742147
|
Local ready
Direct docking supported
|
|
E3L037616
BDB037616
|
BDBM742148
CCN1C(=O)[C@@H](NC(=O)C2(c3ccccc3)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 |
KIHUAMLTZMNPJE-GHVDBIBNSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742148
|
Local ready
Direct docking supported
|
|
E3L037617
BDB037617
|
BDBM742149
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N3C[C@@H](NC)C[C@@H]3C#N)nn(C3CCOCC3)c21
|
C31H36F3N7O4 627.668000 |
ORBTZLRNLJPZPO-APWUFGDNSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742149
|
Local ready
Direct docking supported
|
|
E3L037618
BDB037618
|
BDBM742150
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N3CC[C@@H](NC)[C@@H]3C#N)nn(C3CCOCC3)c21
|
C31H36F3N7O4 627.668000 |
PLTLHHQFWUUVKM-FVEXOFTDSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742150
|
Local ready
Direct docking supported
|
|
E3L037619
BDB037619
|
BDBM742151
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N(C)[C@H](C)C#N)nn(C3CCOCC3)c21
|
C29H33F3N6O4 586.615000 |
AOOYCWUTCINLBX-HNKPZJSLSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742151
|
Local ready
Direct docking supported
|
|
E3L037620
BDB037620
|
BDBM742152
CCN1C(=O)[C@@H](NC(=O)C2CCN(C)CC2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C30H41N7O4 563.703000 |
KBZWHBKHFPKMKV-BRGVPEGFSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742152
|
Local ready
Direct docking supported
|