| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L022601
BDB022601
|
BDBM525703
C[C@@H]1CN(c2ccc(-c3cc(C(N)=O)c(F)cc3F)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)C[C@H](C)N1C
|
C27H26F5N5O3 563.527000 |
DGFHHFXOZVNTQT-OKILXGFUSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM525703; PubChem:CID138558066
|
Local ready
Direct docking supported
|
|
E3L022602
BDB022602
|
BDBM525704
C[C@@H]1CN(c2ccc(-c3ccc(C(=O)NC(C)(C)CC(C)(C)C)c(F)c3F)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)C[C@H](C)N1C
|
C35H42F5N5O3 675.743000 |
LFHCXAGTQPSZQN-BGYRXZFFSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB
BindingDB:BDBM525704
|
Local ready
Direct docking supported
|
|
E3L022603
BDB022603
|
BDBM525705
C[C@@H]1CN(c2ccc(-c3ccc(C(N)=O)c(F)c3F)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)C[C@H](C)N1C
|
C27H26F5N5O3 563.527000 |
JZMTWRYLUQXTLI-OKILXGFUSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM525705; PubChem:CID138558113
|
Local ready
Direct docking supported
|
|
E3L022604
BDB022604
|
BDBM525706
CC1CN(c2ccc(-c3cc(C(=O)NC4CCCCC4)ccc3F)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)CC(C)N1C
|
C33H37F4N5O3 627.683000 |
YFITWOOGOWMDIU-UHFFFAOYSA-N | P61964, Q03164, Q15291 | Histone-lysine N-methyltransferase 2A, WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM525706; PubChem:CID137376373
|
Local ready
Direct docking supported
|
|
E3L022605
BDB022605
|
US11174250, Example 125
C[C@@H]1CN(c2ccc(-c3nc(N4CCOCC4)ncc3F)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)C[C@H](C)N1C
|
C28H31F4N7O3 589.594000 |
ABZPYVVLYOUCEV-CALCHBBNSA-N | P61964, Q03164, Q15291 | Histone-lysine N-methyltransferase 2A, WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM525707; PubChem:CID137376401
|
Local ready
Direct docking supported
|
|
E3L022606
BDB022606
|
BDBM526531
C=CC(=O)N1CCCC(C(=O)Nc2cccc(CNc3nc(NC4CCOCC4)nc4c(C(C)C)cnn34)c2)C1
|
C29H38N8O3 546.676000 |
RCPRNUMVRKHPTG-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526531; PubChem:CID122517713
|
Local ready
Direct docking supported
|
|
E3L022607
BDB022607
|
BDBM526532
C=CC(=O)N1CCC1C(=O)Nc1cccc(CNc2nc(NC3CCOCC3)nc3c(C(C)C)cnn23)c1
|
C27H34N8O3 518.622000 |
JVAPFLBAEURREJ-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526532; PubChem:CID122536931
|
Local ready
Direct docking supported
|
|
E3L022608
BDB022608
|
BDBM526533
C=CC(=O)N1CCCC1C(=O)Nc1cccc(CNc2nc(NC3CCOCC3)nc3c(C(C)C)cnn23)c1
|
C28H36N8O3 532.649000 |
CQGSKPPSPMWAPE-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526533; PubChem:CID134281404
|
Local ready
Direct docking supported
|
|
E3L022609
BDB022609
|
BDBM526534
C=CC(=O)N1CCC(C(=O)Nc2cccc(CNc3nc(NC4CCOCC4)nc4c(C(C)C)cnn34)c2)C1
|
C28H36N8O3 532.649000 |
GPDBJFPOOGCXPZ-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526534; PubChem:CID122537010
|
Local ready
Direct docking supported
|
|
E3L022610
BDB022610
|
BDBM526537
C=CC(=O)N[C@H]1CC[C@@H](C(=O)Nc2cccc(CNc3nc(NC4CCOCC4)nc4c(C(C)C)cnn34)c2)CC1
|
C30H40N8O3 560.703000 |
AXSJQCHFTUTOCQ-SZPZYZBQSA-N | P51948 | Cyclin-H |
BindingDB
BindingDB:BDBM526537
|
Local ready
Direct docking supported
|
|
E3L022611
BDB022611
|
BDBM526538
C=CC(=O)N1CCCC(C(=O)Nc2cccc(CNc3nc(NC4CCN(C)CC4)nc4c(C(C)C)cnn34)c2)C1
|
C30H41N9O2 559.719000 |
HMAVGSMOAUBMJF-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526538; PubChem:CID134281395
|
Local ready
Direct docking supported
|
|
E3L022612
BDB022612
|
BDBM526539
C=CC(=O)N[C@H]1CC[C@@H](C(=O)Nc2cccc(CNc3nc(N[C@H]4CC[C@H](O)CC4)nc4c(C(C)C)cnn34)c2)CC1
|
C31H42N8O3 574.730000 |
ONEXNQKMGKVENG-TWMYTPEGSA-N | P51948 | Cyclin-H |
BindingDB
BindingDB:BDBM526539
|
Local ready
Direct docking supported
|
|
E3L022613
BDB022613
|
BDBM526540
C=CC(=O)N[C@H]1CC[C@@H](C(=O)Nc2cccc(CNc3nc(NC4CCCC(O)C4)nc4c(C(C)C)cnn34)c2)CC1
|
C31H42N8O3 574.730000 |
XVCFTTIVYZTNOY-QHSWPGFUSA-N | P51948 | Cyclin-H |
BindingDB
BindingDB:BDBM526540
|
Local ready
Direct docking supported
|
|
E3L022614
BDB022614
|
BDBM526541
C=CC(=O)N[C@H]1CC[C@H](C(=O)Nc2cccc(CNc3nc(NC4CCCC(O)C4)nc4c(C(C)C)cnn34)c2)CC1
|
C31H42N8O3 574.730000 |
XVCFTTIVYZTNOY-BXRLGOFVSA-N | P51948 | Cyclin-H |
BindingDB
BindingDB:BDBM526541
|
Local ready
Direct docking supported
|
|
E3L022615
BDB022615
|
BDBM526542
C=CC(=O)N1CCC(C(=O)Nc2cccc(CNc3nc(N[C@H]4CCC[C@@H](O)C4)nc4c(C(C)C)cnn34)c2)C1
|
C29H38N8O3 546.676000 |
MPRGZJIDIZHMNQ-XGELLPRESA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526542; PubChem:CID163199942
|
Local ready
Direct docking supported
|
|
E3L022616
BDB022616
|
BDBM526543
C=CC(=O)N1CCC(C(=O)Nc2cccc(CNc3nc(N[C@H]4CCC[C@H](O)C4)nc4c(C(C)C)cnn34)c2)C1
|
C29H38N8O3 546.676000 |
MPRGZJIDIZHMNQ-FALYVICWSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526543; PubChem:CID163199943
|
Local ready
Direct docking supported
|
|
E3L022617
BDB022617
|
BDBM526544
C=CC(=O)N1CCC(C(=O)Nc2cccc(CNc3nc(N[C@@H]4CCNC[C@H]4F)nc4c(C(C)C)cnn34)c2)C1
|
C28H36FN9O2 549.655000 |
KGHZKXNQBOKOPW-QENMJEOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526544; PubChem:CID122536937
|
Local ready
Direct docking supported
|
|
E3L022618
BDB022618
|
BDBM526545
C=CC(=O)N1CCC(C(=O)Nc2cccc(CNc3nc(NC4CCCC(N)C4)nc4c(C(C)C)cnn34)c2)C1
|
C29H39N9O2 545.692000 |
ADWXJDLAQHGNIE-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526545; PubChem:CID134281393
|
Local ready
Direct docking supported
|
|
E3L022619
BDB022619
|
BDBM526546
C=CC(=O)N1CCCCC1C(=O)Nc1cccc(CNc2nc(N[C@H]3CCCOC3)nc3c(C(C)C)cnn23)c1
|
C29H38N8O3 546.676000 |
JIVCYBOEYULWCW-OWJIYDKWSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526546; PubChem:CID122517761
|
Local ready
Direct docking supported
|
|
E3L022620
BDB022620
|
BDBM526547
CC(C)=CC(=O)N1CCC1C(=O)Nc1cccc(CNc2nc(NC3CCOCC3)nc3c(C(C)C)cnn23)c1
|
C29H38N8O3 546.676000 |
HVOCJQXJUFXWCM-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526547; PubChem:CID122517860
|
Local ready
Direct docking supported
|