| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L041841
BDB041841
|
BDBM775455
C=C(CN1CC2(COC2)C1)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 |
COZDCZYUIUJCAK-SAIUNTKASA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775455
|
Local ready
Direct docking supported
|
|
E3L041842
BDB041842
|
BDBM775456
C/C=C(\CN1CCOCC1)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 |
YUYDREWVWQHOCV-VURWHFMOSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775456
|
Local ready
Direct docking supported
|
|
E3L041843
BDB041843
|
BDBM775457
C=C(CN1CCOCC1)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 |
CIBRAURYTKNGMN-JHOUSYSJSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775457
|
Local ready
Direct docking supported
|
|
E3L041844
BDB041844
|
BDBM775458
C=C(C(=O)N(C)Cc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(C3CC3)n2)c1)C(C)N1CC2CC(C1)O2
|
C39H44N8O4 688.833000 |
FHBACILKQSWBBK-ZCWHLLJVSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775458
|
Local ready
Direct docking supported
|
|
E3L041845
BDB041845
|
BDBM775459
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)N1CC2CC(C1)O2
|
C36H37F3N8O4 702.738000 |
GJRIIVSCZJZCPX-OJWQUJQHSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775459
|
Local ready
Direct docking supported
|
|
E3L041846
BDB041846
|
BDBM775460
C/C=C(\CN1CCN(C2COC2)CC1)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(C3CC3)n2)c1
|
C40H47N9O4 717.875000 |
BTPOIGWLEPABFS-WESWGVQKSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775460
|
Local ready
Direct docking supported
|
|
E3L041847
BDB041847
|
BDBM775461
C=C(CN1C2CCC1COC2)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2cccc(C(F)(F)F)c2)c1
|
C39H39F3N6O4 712.773000 |
QWKNUXRRBPYFHX-RHHULBOPSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775461
|
Local ready
Direct docking supported
|
|
E3L041848
BDB041848
|
BDBM775462
C=C(CN1CC2CC(C1)O2)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2cccc(C(F)(F)F)c2)c1
|
C38H37F3N6O4 698.746000 |
LEKGUZWCJVFXMF-HYIJIZHWSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775462
|
Local ready
Direct docking supported
|
|
E3L041849
BDB041849
|
BDBM775463
C=C(CN1CC(O)C1)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2cccc(C(F)(F)F)c2)c1
|
C36H35F3N6O4 672.708000 |
ACEQSTGGXWRFHB-JSOSNVBQSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775463
|
Local ready
Direct docking supported
|
|
E3L041850
BDB041850
|
BDBM775464
C=C(CN1CC2CCC(C1)O2)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 |
BZHURPFXHOVJSR-OJDDDSAVSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775464
|
Local ready
Direct docking supported
|
|
E3L041851
BDB041851
|
BDBM775465
C=C(CN1CC2CCC1CO2)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2cccc(C(F)(F)F)c2)c1
|
C39H39F3N6O4 712.773000 |
CLZYZQKNFVUFIZ-RHHULBOPSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775465
|
Local ready
Direct docking supported
|
|
E3L041852
BDB041852
|
BDBM775466
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-PISFIIHWSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775466
|
Local ready
Direct docking supported
|
|
E3L041853
BDB041853
|
BDBM775467
C=C(CN1CCOCC1)C(=O)N(C)Cc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(C(F)(F)F)n2)c1
|
C35H37F3N8O4 690.727000 |
ATHIVJWZGIHRCB-IHLOFXLRSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775467
|
Local ready
Direct docking supported
|
|
E3L041854
BDB041854
|
BDBM775468
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)N1CCOCC1
|
C35H37F3N8O4 690.727000 |
VMXYDMCDJIPPAS-QLALBXJDSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775468
|
Local ready
Direct docking supported
|
|
E3L041855
BDB041855
|
BDBM775469
C=C(CN1CCOCC1)C(=O)NCc1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2ccn(CC(F)(F)F)n2)c1
|
C35H37F3N8O4 690.727000 |
LRVVJVUELBBQFT-IHLOFXLRSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775469
|
Local ready
Direct docking supported
|
|
E3L041856
BDB041856
|
BDBM775470
C=C(CN1CCOCC1)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 |
LXQNLHZSMCSVRF-IHLOFXLRSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775470
|
Local ready
Direct docking supported
|
|
E3L041857
BDB041857
|
BDBM775471
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-GSEMILKTSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775471
|
Local ready
Direct docking supported
|
|
E3L041858
BDB041858
|
BDBM775472
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@@H](C)N(C)C1COC1
|
C36H37F3N8O4 702.738000 |
VJHRTXQBWPDPSV-UVQZXEQTSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775472
|
Local ready
Direct docking supported
|
|
E3L041859
BDB041859
|
BDBM775473
C/C=C(\CN1CCN(C2COC2)CC1)C(=O)N(C)c1cccc([C@@H]2c3cnn(-c4ccccc4)c3N(CC)C(=O)[C@H]2NC(=O)c2csc(C(F)(F)F)n2)c1
|
C38H41F3N8O4S 762.859000 |
DGZHJCFBVWVATQ-KGEWJYCYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775473
|
Local ready
Direct docking supported
|
|
E3L041860
BDB041860
|
BDBM775474
C/C=C(\CN1CC2(COC2)C1)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 |
AMHXRFOGBODYPV-VURWHFMOSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM775474
|
Local ready
Direct docking supported
|