| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L041801
BDB041801
|
BDBM775415
C/C=C(\CN1CCN(C2COC2)CC1)C(=O)Nc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(C3CC3)n2)c1
|
C39H45N9O4 703.848000 |
GKPPMKUFVLUIHY-PFHWJTIQSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775415
|
Local ready
Direct docking supported
|
|
E3L041802
BDB041802
|
BDBM775416
C/C=C(\CN1CCN(C2COC2)CC1)C(=O)Nc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2csc(C(F)(F)F)n2)c1
|
C37H39F3N8O4S 748.832000 |
BQDQBSXTAJRWDQ-REPVNRSVSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775416
|
Local ready
Direct docking supported
|
|
E3L041803
BDB041803
|
BDBM775417
C/C=C(\CN1CC2(COC2)C1)C(=O)N(C)Cc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2nccc(C(F)(F)F)n2)c1
|
C38H39F3N8O4 728.776000 |
MXRZGUXKMIVZDU-PUIXBDEISA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775417
|
Local ready
Direct docking supported
|
|
E3L041804
BDB041804
|
BDBM775418
C=C(CN1CC2CC1CO2)C(=O)NCc1cccc([C@@H]2c3c(C)nn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2cccc(C(F)(F)F)c2)c1
|
C39H39F3N6O4 712.773000 |
DLANXOVSELCZAP-RHHULBOPSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775418
|
Local ready
Direct docking supported
|
|
E3L041805
BDB041805
|
BDBM775419
C/C=C(\CN1CCN(C2COC2)CC1)C(=O)N(C)Cc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(C(F)(F)F)n2)c1
|
C39H44F3N9O4 759.834000 |
HDLRGLHIEDQHIN-MSBIAQBTSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775419
|
Local ready
Direct docking supported
|
|
E3L041806
BDB041806
|
BDBM775420
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H](c2cccc(CN(C)C/C=C/C(=O)OC(C)(C)C)c2)c2cnn(-c3ccccc3)c21
|
C38H40F3N5O4 687.763000 |
YDYTXXJKLDBARM-KUZWAKMJSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775420
|
Local ready
Direct docking supported
|
|
E3L041807
BDB041807
|
BDBM775421
C=C(CN(C)C1COC1)C(=O)N(C)Cc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(C3CC3)n2)c1
|
C37H42N8O4 662.795000 |
URLAVCHOZPHPAF-SAIUNTKASA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775421
|
Local ready
Direct docking supported
|
|
E3L041808
BDB041808
|
BDBM775422
C=C(C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(C3CC3)n2)c1)C(C)N1CC2CC(C1)O2
|
C38H42N8O4 674.806000 |
AFWHCIPQJSTBJD-YALBYERWSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775422
|
Local ready
Direct docking supported
|
|
E3L041809
BDB041809
|
BDBM775423
C/C=C(\CN1CCOCC1)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(C3CC3)n2)c1
|
C37H42N8O4 662.795000 |
LBVBXMYNWRVWOT-JPKCQDGRSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775423
|
Local ready
Direct docking supported
|
|
E3L041810
BDB041810
|
BDBM775424
C/C=C(\CN1CCN(C2COC2)CC1)C(=O)N(C)Cc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2nccc(C(F)(F)F)n2)c1
|
C40H44F3N9O4 771.845000 |
YLDMOZRRKMMALH-MSBIAQBTSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775424
|
Local ready
Direct docking supported
|
|
E3L041811
BDB041811
|
BDBM775425
C/C=C(\CN1CC2(COC2)C1)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2nccc(C(F)(F)F)n2)c1
|
C37H37F3N8O4 714.749000 |
QIASKOIBHZKKIL-VURWHFMOSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775425
|
Local ready
Direct docking supported
|
|
E3L041812
BDB041812
|
BDBM775426
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-JSOSNVBQSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775426
|
Local ready
Direct docking supported
|
|
E3L041813
BDB041813
|
BDBM775427
CCN1C(=O)[C@@H](NC(=O)c2nccc(C(F)(F)F)n2)[C@H](c2cccc(NC(=O)/C=C/C(=O)N(C)C)c2)c2c(C)nn(-c3ccccc3)c21
|
C33H31F3N8O4 660.657000 |
FFAVSKRLZLWXLX-XDHQRVKSSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775427
|
Local ready
Direct docking supported
|
|
E3L041814
BDB041814
|
BDBM775428
C=C(CN1CCC12COC2)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 |
CEGQOJCNSUMAOI-WDYNHAJCSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775428
|
Local ready
Direct docking supported
|
|
E3L041815
BDB041815
|
BDBM775429
C=C(CN1CCC12COC2)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(C(F)(F)F)n2)c1
|
C35H35F3N8O4 688.711000 |
JCZLHYXZCGRWRZ-WDYNHAJCSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775429
|
Local ready
Direct docking supported
|
|
E3L041816
BDB041816
|
BDBM775430
C/C=C(\CN(C)C1COC1)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(C(F)(F)F)n2)c1
|
C35H37F3N8O4 690.727000 |
BXBCBNMXQPZWSQ-QYTMENBESA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775430
|
Local ready
Direct docking supported
|
|
E3L041817
BDB041817
|
BDBM775431
CCN1C(=O)[C@@H](NC(=O)c2nccc(C(F)(F)F)n2)[C@H](c2cccc(C(=O)N3CCC[C@H]3C#N)c2)c2cnn(-c3ccccc3)c21
|
C32H27F3N8O3 628.615000 |
RBYGCOAPVLAGPO-DFCKQENNSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775431
|
Local ready
Direct docking supported
|
|
E3L041818
BDB041818
|
BDBM775432
CCN1C(=O)[C@@H](NC(=O)c2nccc(C(F)(F)F)n2)[C@H](c2cccc(C(=O)N3CCC[C@@H]3C#N)c2)c2cnn(-c3ccccc3)c21
|
C32H27F3N8O3 628.615000 |
RBYGCOAPVLAGPO-RCXJIHSJSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775432
|
Local ready
Direct docking supported
|
|
E3L041819
BDB041819
|
BDBM775433
C/C=C(\CN1CCC12COC2)C(=O)Nc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2nccc(C(F)(F)F)n2)c1
|
C36H35F3N8O4 700.722000 |
UBRKSSYDXLNSCT-OINLKUGXSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775433
|
Local ready
Direct docking supported
|
|
E3L041820
BDB041820
|
BDBM775434
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-MPQUPPDSSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775434
|
Local ready
Direct docking supported
|