| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L041821
BDB041821
|
BDBM775435
C=C(CN1CC2CC(C1)O2)C(=O)N(C)Cc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(C(F)(F)F)n2)c1
|
C36H37F3N8O4 702.738000 |
IMJWQURZQDHKPB-OJDDDSAVSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775435
|
Local ready
Direct docking supported
|
|
E3L041822
BDB041822
|
BDBM775436
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:BDBM775436
|
Local ready
Direct docking supported
|
|
E3L041823
BDB041823
|
BDBM775437
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H](c2cccc(CN(C)C/C=C/C(=O)N3CCCC3)c2)c2cnn(-c3ccccc3)c21
|
C38H39F3N6O3 684.763000 |
XSXZDUZEMNZOAH-XOBVPPHASA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775437
|
Local ready
Direct docking supported
|
|
E3L041824
BDB041824
|
BDBM775438
C=C(C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2nccc(C(F)(F)F)n2)c1)C(C)N1CCC12COC2
|
C37H37F3N8O4 714.749000 |
XIROZHKHHMSDHP-QLALBXJDSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775438
|
Local ready
Direct docking supported
|
|
E3L041825
BDB041825
|
BDBM775439
C/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)c1
|
C39H42F3N9O4 757.818000 |
JURMPEGZHPNREX-SIUJZCOZSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775439
|
Local ready
Direct docking supported
|
|
E3L041826
BDB041826
|
BDBM775440
C=C(CN1CC2CC(C1)O2)C(=O)N(C)Cc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(C3CC3)n2)c1
|
C38H42N8O4 674.806000 |
CIYMORZWYDCXQO-FLYOXLRNSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775440
|
Local ready
Direct docking supported
|
|
E3L041827
BDB041827
|
BDBM775441
CCN1C(=O)[C@@H](NC(=O)c2nccc(C(F)(F)F)n2)[C@H](c2ccccc2/C=C/C#N)c2cnn(-c3ccccc3)c21
|
C29H22F3N7O2 557.536000 |
PQEWVBQEYPSEOV-WNEMFYEBSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM775441; PubChem:CID176327715
|
Local ready
Direct docking supported
|
|
E3L041828
BDB041828
|
BDBM775442
CCN1C(=O)[C@@H](NC(=O)c2nccc(C(F)(F)F)n2)[C@H](c2ccccc2/C=C\C#N)c2cnn(-c3ccccc3)c21
|
C29H22F3N7O2 557.536000 |
PQEWVBQEYPSEOV-AHWCPQFYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM775442; PubChem:CID176327661
|
Local ready
Direct docking supported
|
|
E3L041829
BDB041829
|
BDBM775443
C=C(CN1CC(F)(F)C1)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2nccc(C(F)(F)F)n2)c1
|
C34H31F5N8O3 694.665000 |
MJTAZEKSROUGKW-SXOMAYOGSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775443
|
Local ready
Direct docking supported
|
|
E3L041830
BDB041830
|
BDBM775444
CCN1C(=O)[C@@H](NC(=O)c2nccc(C(F)(F)F)n2)[C@H](c2cccc(NC(=O)/C=C/C(=O)N3CCCC3)c2)c2c(C)nn(-c3ccccc3)c21
|
C35H33F3N8O4 686.695000 |
ZAARPKFTXCLYFU-CKZNVODNSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775444
|
Local ready
Direct docking supported
|
|
E3L041831
BDB041831
|
BDBM775445
CCN1C(=O)[C@@H](NC(=O)c2nccc(C(F)(F)F)n2)[C@H](c2cccc(CN3CC=CS3(=O)=O)c2)c2cnn(-c3ccccc3)c21
|
C30H26F3N7O4S 637.644000 |
CAUYKOFBGXEULL-RPBOFIJWSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775445
|
Local ready
Direct docking supported
|
|
E3L041832
BDB041832
|
BDBM775446
C=C(CN1CCCC1)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2cccc(C(F)(F)F)c2)c1
|
C37H37F3N6O3 670.736000 |
PBLLYARBJJCYHE-ZWXJPIIXSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775446
|
Local ready
Direct docking supported
|
|
E3L041833
BDB041833
|
BDBM775447
CCN1C(=O)[C@@H](NC(=O)c2nccc(C(F)(F)F)n2)[C@H](c2cccc(NC(=O)/C=C/CN(C)C)n2)c2cnn(-c3ccccc3)c21
|
C31H30F3N9O3 633.635000 |
PHPPKQPXKRAPQZ-WGBVHHKQSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775447
|
Local ready
Direct docking supported
|
|
E3L041834
BDB041834
|
BDBM775448
C=C(CN1CCOCC1)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccnn2C)c1
|
C34H38N8O4 622.730000 |
FRZNTEYYUFUEMU-IHLOFXLRSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775448
|
Local ready
Direct docking supported
|
|
E3L041835
BDB041835
|
BDBM775449
C=C(C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2cccc(C(F)F)c2)c1)C(C)N(C)C1COC1
|
C38H40F2N6O4 682.772000 |
BBIQTYZVGVQIBX-CXIYRKSASA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775449
|
Local ready
Direct docking supported
|
|
E3L041836
BDB041836
|
BDBM775450
C=C(C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2csc(C)n2)c1)C(C)N(C)C1COC1
|
C35H39N7O4S 653.809000 |
YYSYWOSQSBPLRA-HNYVPYTLSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775450
|
Local ready
Direct docking supported
|
|
E3L041837
BDB041837
|
BDBM775451
CCN1C(=O)[C@@H](NC(=O)c2nccc(C(F)(F)F)n2)[C@H](c2cccc(NC(=O)C3=CCC3)n2)c2cnn(-c3ccccc3)c21
|
C30H25F3N8O3 602.577000 |
CILTYYOAWWKLEJ-ZEQRLZLVSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775451
|
Local ready
Direct docking supported
|
|
E3L041838
BDB041838
|
BDBM775452
C=C(CN1CCOCC1)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(C3CC3)n2)c1
|
C36H40N8O4 648.768000 |
USPKMIFGKPDEME-ZWXJPIIXSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775452
|
Local ready
Direct docking supported
|
|
E3L041839
BDB041839
|
BDBM775453
C=C(CN1CCOCC1)C(=O)N[C@H](C)c1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2nccc(C(F)(F)F)n2)c1
|
C36H37F3N8O4 702.738000 |
FPHGLYAISUUOLS-NWSMARCJSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775453
|
Local ready
Direct docking supported
|
|
E3L041840
BDB041840
|
BDBM775454
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H](c2cccc3c2CN(C#N)C3)c2cnn(-c3ccccc3)c21
|
C31H25F3N6O2 570.575000 |
HLGTVUXTDADADV-SXOMAYOGSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM775454; PubChem:CID176327609
|
Local ready
Direct docking supported
|