| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L037561
BDB037561
|
BDBM742093
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N3CCNC[C@H]3C#N)nn(C3CCOCC3)c21
|
C33H33F4N7O4 667.664000 |
NWKLEUNNRSEEIU-OBDYRVMHSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742093
|
Local ready
Direct docking supported
|
|
E3L037562
BDB037562
|
BDBM742094
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N3CCNC[C@@H]3C#N)nn(C3CCOCC3)c21
|
C33H33F4N7O4 667.664000 |
NWKLEUNNRSEEIU-KLJDGLGGSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742094
|
Local ready
Direct docking supported
|
|
E3L037563
BDB037563
|
BDBM742095
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N(CC#N)CC#N)nn(C3CCOCC3)c21
|
C32H29F4N7O4 651.621000 |
UJLDCNZXOUCPIB-AHWVRZQESA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742095
|
Local ready
Direct docking supported
|
|
E3L037564
BDB037564
|
BDBM742096
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N(C)CC#N)nn(C3CCOCC3)c21
|
C31H30F4N6O4 626.611000 |
XFXZVTUSOWPZBM-ZCYQVOJMSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742096
|
Local ready
Direct docking supported
|
|
E3L037565
BDB037565
|
BDBM742097
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)C#N)nn(C3CCOCC3)c21
|
C32H32F4N6O4 640.638000 |
AKDQORBAMAABPF-VAQLEPBLSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742097
|
Local ready
Direct docking supported
|
|
E3L037566
BDB037566
|
BDBM742098
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)C#N)nn(C3CCOCC3)c21
|
C32H32F4N6O4 640.638000 |
AKDQORBAMAABPF-SQOVJYTMSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742098
|
Local ready
Direct docking supported
|
|
E3L037567
BDB037567
|
BDBM742099
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)C)nn(C3CCOCC3)c21
|
C35H39F4N7O4 697.734000 |
CVZGYXKFDIVWRX-XQFUHLNNSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742099
|
Local ready
Direct docking supported
|
|
E3L037568
BDB037568
|
BDBM742100
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)C)nn(C3CCOCC3)c21
|
C35H39F4N7O4 697.734000 |
CVZGYXKFDIVWRX-YCVJPRETSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742100
|
Local ready
Direct docking supported
|
|
E3L037569
BDB037569
|
BDBM742101
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N3CCNC[C@@H]3C#N)nn(C3CCOCC3)c21
|
C30H34F3N7O4 613.641000 |
WNVHCTVGBHINRG-FIXSFTCYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742101; PubChem:CID176733849
|
Local ready
Direct docking supported
|
|
E3L037570
BDB037570
|
BDBM742102
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N3C[C@H](F)C[C@H]3C#N)nn(C3CCOCC3)c21
|
C30H32F4N6O4 616.616000 |
PLPNMLJNLOLDNH-LTYHASHMSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742102
|
Local ready
Direct docking supported
|
|
E3L037571
BDB037571
|
BDBM742103
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N(CC#N)CC#N)nn(C3CCOCC3)c21
|
C29H30F3N7O4 597.598000 |
FNBYCALONQOWFI-GMAHTHKFSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742103; PubChem:CID176733851
|
Local ready
Direct docking supported
|
|
E3L037572
BDB037572
|
BDBM742104
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N(C)CC#N)nn(C3CCOCC3)c21
|
C28H31F3N6O4 572.588000 |
KNCVCWMCOKSTIG-UNMCSNQZSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742104
|
Local ready
Direct docking supported
|
|
E3L037573
BDB037573
|
BDBM742105
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CCC2)c2c(C(=O)N(C)C(C)C#N)nn(C3CCOCC3)c21
|
C30H35F3N6O4 600.642000 |
OORGMXTUULMMCT-TWWXXLKNSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742105
|
Local ready
Direct docking supported
|
|
E3L037574
BDB037574
|
BDBM742106
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CCCC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C33H37F3N6O4 638.691000 |
KYDYLHCEJUHRPD-GHVDBIBNSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742106
|
Local ready
Direct docking supported
|
|
E3L037575
BDB037575
|
BDBM742107
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N3C[C@H](OC)C[C@H]3C#N)nn(C3CCOCC3)c21
|
C31H35F3N6O5 628.652000 |
JBMPBLJFJZPQJG-AANQFLQQSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742107
|
Local ready
Direct docking supported
|
|
E3L037576
BDB037576
|
BDBM742108
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N3CC(F)(F)C[C@H]3C#N)nn(C3CCOCC3)c21
|
C30H31F5N6O4 634.606000 |
AIOGXKRYWKAJDQ-FUDKSRODSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742108
|
Local ready
Direct docking supported
|
|
E3L037577
BDB037577
|
BDBM742109
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(C3CCOCC3)c21
|
C30H33F3N6O6S 662.691000 |
MWHPXEHXYXKYCT-GPXNEJASSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742109
|
Local ready
Direct docking supported
|
|
E3L037578
BDB037578
|
BDBM742110
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N3CCOC[C@H]3C)nn(C3CCOCC3)c21
|
C33H35F4N5O5 657.665000 |
IYNSUNFJNCWHII-KAZGAHJFSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742110
|
Local ready
Direct docking supported
|
|
E3L037579
BDB037579
|
BDBM742111
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N3CCOC[C@H]3C#N)nn(C3CCOCC3)c21
|
C30H33F3N6O5 614.625000 |
VMNSTQYXEPUSQN-GPXNEJASSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742111; PubChem:CID176733859
|
Local ready
Direct docking supported
|
|
E3L037580
BDB037580
|
BDBM742112
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-CUYJMHBOSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742112; PubChem:CID176733860
|
Local ready
Direct docking supported
|