| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L041901
BDB041901
|
BDBM775515
C=C(C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(C(F)(F)F)n2)c1)C(C)N1CCC12COC2
|
C36H37F3N8O4 702.738000 |
ARIKHOMOAQLDCJ-QLALBXJDSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775515
|
Local ready
Direct docking supported
|
|
E3L041902
BDB041902
|
BDBM775516
C=C(CN(C)C1COC1)C(=O)N(C)Cc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2nccc(C(F)(F)F)n2)c1
|
C36H37F3N8O4 702.738000 |
JVGSUWJXHIKSNW-IHLOFXLRSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775516
|
Local ready
Direct docking supported
|
|
E3L041903
BDB041903
|
BDBM775517
C=C(CN1CC2CC(C1)O2)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2nccc(C(F)(F)F)n2)c1
|
C36H35F3N8O4 700.722000 |
DUTGZLLDHUCXHY-KFCVGBSGSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775517
|
Local ready
Direct docking supported
|
|
E3L041904
BDB041904
|
BDBM775518
C=C(CN1CC2CCC(C1)O2)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(C(F)(F)F)n2)c1
|
C36H37F3N8O4 702.738000 |
ZXQZPJUYRTYWRD-OJDDDSAVSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775518
|
Local ready
Direct docking supported
|
|
E3L041905
BDB041905
|
BDBM775519
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H](c2cccc(CNC(=O)C3=CCN(C)C3)n2)c2cnn(-c3ccccc3)c21
|
C34H32F3N7O3 643.670000 |
LKCSPZMDEXJUEE-VMPREFPWSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775519
|
Local ready
Direct docking supported
|
|
E3L041906
BDB041906
|
BDBM775520
C=C(CN(C)C1COC1)C(=O)NCc1cccc([C@H]2c3c(C)nn(-c4ccccc4)c3N(CC)C(=O)[C@@H]2NC(=O)c2cccc(C(F)(F)F)c2)c1
|
C38H39F3N6O4 700.762000 |
MNXNERCAHKRFSH-JHOUSYSJSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775520
|
Local ready
Direct docking supported
|
|
E3L041907
BDB041907
|
BDBM775521
CCN1C(=O)[C@@H](NC(=O)c2nccc(C(F)(F)F)n2)[C@H](c2cccc(C(=O)N3C[C@H](F)C[C@H]3C#N)c2)c2cnn(-c3ccccc3)c21
|
C32H26F4N8O3 646.605000 |
QGOJLHRVUGESPW-VAXWOWNTSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775521
|
Local ready
Direct docking supported
|
|
E3L041908
BDB041908
|
BDBM775522
C=C(CN1CCOCC1)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(CC)n2)c1
|
C35H40N8O4 636.757000 |
NGLIXILQMJKSFK-JSOSNVBQSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775522
|
Local ready
Direct docking supported
|
|
E3L041909
BDB041909
|
BDBM775523
C=C(C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2csc(C(F)(F)F)n2)c1)C(C(C)C)N(C)C1COC1
|
C37H40F3N7O4S 735.833000 |
JNJMYIYPHVDMKQ-AWZUCMKVSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775523
|
Local ready
Direct docking supported
|
|
E3L041910
BDB041910
|
BDBM775524
C=C(CN1CCN(C2COC2)CC1)C(=O)NCc1cccc([C@@H]2c3c(C)nn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2cccc(C(F)(F)F)c2)c1
|
C41H44F3N7O4 755.842000 |
CCOJMFMRURYVQC-XDSPJLLDSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775524
|
Local ready
Direct docking supported
|
|
E3L041911
BDB041911
|
BDBM775525
C=C(CN1CCN(C2COC2)CC1)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2nccc(C(F)(F)F)n2)n1
|
C37H39F3N10O4 744.779000 |
KGVYBKJOWKNWSP-CONSDPRKSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775525
|
Local ready
Direct docking supported
|
|
E3L041912
BDB041912
|
BDBM775526
C=C(C(=O)N(C)Cc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(C(F)(F)F)n2)c1)C(C)N(C)C1COC1
|
C36H39F3N8O4 704.754000 |
DGTDDOVQJVDUNZ-PEHFHTAYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775526
|
Local ready
Direct docking supported
|
|
E3L041913
BDB041913
|
BDBM775527
C=C(CN1CCN(C2COC2)CC1)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(C(F)(F)F)n2)c1
|
C37H40F3N9O4 731.780000 |
VDOVNNQURNDTPC-ZWXJPIIXSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775527
|
Local ready
Direct docking supported
|
|
E3L041914
BDB041914
|
BDBM775528
C=C(CN1CCOCC1)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(CCF)n2)c1
|
C35H39FN8O4 654.747000 |
JOMRRZOYDVLZMQ-JSOSNVBQSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775528
|
Local ready
Direct docking supported
|
|
E3L041915
BDB041915
|
BDBM775529
CCC(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2nccc(C(F)(F)F)n2)c1
|
C30H28F3N7O3 591.594000 |
JTRDYIAQXASFGV-RPBOFIJWSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM775529; PubChem:CID177859481
|
Local ready
Direct docking supported
|
|
E3L041916
BDB041916
|
BDBM775530
CCN1C(=O)[C@@H](NC(=O)c2nccc(C(F)(F)F)n2)[C@H](c2cccc(NC(=O)/C=C/C(=O)OC(C)(C)C)c2)c2c(C)nn(-c3ccccc3)c21
|
C35H34F3N7O5 689.695000 |
OUGSQEMANBCDPU-DPDPCTSHSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775530
|
Local ready
Direct docking supported
|
|
E3L041917
BDB041917
|
BDBM775531
CCN1C(=O)[C@@H](NC(=O)c2nccc(C(F)(F)F)n2)[C@H](c2cccc(CNC(=O)C(COC)CN3CCC(F)(F)C3)c2)c2cnn(-c3ccccc3)c21
|
C36H37F5N8O4 740.734000 |
MPYRMUJDQLRUMJ-QAMDSPJSSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775531
|
Local ready
Direct docking supported
|
|
E3L041918
BDB041918
|
BDBM775532
C=C(CN1CC(C)(O)C1)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2cccc(C(F)(F)F)c2)c1
|
C37H37F3N6O4 686.735000 |
BPHREVKYGGRRMA-JSOSNVBQSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775532
|
Local ready
Direct docking supported
|
|
E3L041919
BDB041919
|
BDBM775533
CCN1C(=O)[C@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2cccc(CNC(=O)C3=CCN(C)C3)c2)c2c(C)nn(-c3ccccc3)c21
|
C36H35F3N6O3 656.709000 |
BRMGSVIEKRJHMP-IOWSJCHKSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775533
|
Local ready
Direct docking supported
|
|
E3L041920
BDB041920
|
BDBM775534
C/C=C(\CN1CCOCC1)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2nccc(C(F)(F)F)n2)c1
|
C36H37F3N8O4 702.738000 |
FLXMSBSXZXPVTD-VURWHFMOSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775534
|
Local ready
Direct docking supported
|