| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L022641
BDB022641
|
BDBM526568
C=CC(=O)N[C@H]1CC[C@@H](C(=O)Nc2cccc(CNc3nc(NC4CCOCC4)nc4c(C(C)C)cnn34)c2F)CC1
|
C30H39FN8O3 578.693000 |
UHLXABHWADOGJK-TYKWCNGQSA-N | P51948 | Cyclin-H |
BindingDB
BindingDB:BDBM526568
|
Local ready
Direct docking supported
|
|
E3L022642
BDB022642
|
BDBM526569
C=CC(=O)N[C@H]1CC[C@@H](C(=O)Nc2ccc(F)c(CNc3nc(NC4CCOCC4)nc4c(C(C)C)cnn34)c2)CC1
|
C30H39FN8O3 578.693000 |
VZWWEOLFBTUSFX-TYKWCNGQSA-N | P51948 | Cyclin-H |
BindingDB
BindingDB:BDBM526569
|
Local ready
Direct docking supported
|
|
E3L022643
BDB022643
|
BDBM526570
C=CC(=O)N1CCOCC1C(=O)Nc1cncc(CNc2nc(NC3CCOCC3)nc3c(C(C)C)cnn23)c1
|
C27H35N9O4 549.636000 |
TYZQGXYAWLLTSU-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526570; PubChem:CID122536988
|
Local ready
Direct docking supported
|
|
E3L022644
BDB022644
|
BDBM526571
C=CC(=O)N1CCC[C@H](NC(=O)c2cccc(CNc3nc(NC4CCOCC4)nc4c(C(C)C)cnn34)c2)C1
|
C29H38N8O3 546.676000 |
KEGHGZFHMWIENR-QHCPKHFHSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526571; PubChem:CID122536908
|
Local ready
Direct docking supported
|
|
E3L022645
BDB022645
|
BDBM526572
C=CC(=O)N1CCC1C(=O)Nc1cc(CNc2nc(NC3CCOCC3)nc3c(C(C)C)cnn23)ccc1F
|
C27H33FN8O3 536.612000 |
RSIBRBGQEGWZRV-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526572; PubChem:CID134301270
|
Local ready
Direct docking supported
|
|
E3L022646
BDB022646
|
BDBM526573
C=CC(=O)N1CCC(C(=O)Nc2cc(CNc3nc(NC4CCOCC4)nc4c(C(C)C)cnn34)ccc2F)C1
|
C28H35FN8O3 550.639000 |
LDURVJVJRHDJIV-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526573; PubChem:CID134301283
|
Local ready
Direct docking supported
|
|
E3L022647
BDB022647
|
BDBM526574
C=CC(=O)N1CCCCC1C(=O)Nc1cc(CNc2nc(NC3CCOCC3)nc3c(C(C)C)cnn23)ccc1F
|
C29H37FN8O3 564.666000 |
JHUHPSALXXQVAT-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526574; PubChem:CID122536941
|
Local ready
Direct docking supported
|
|
E3L022648
BDB022648
|
BDBM526575
C=CC(=O)N1CCCC(C(=O)Nc2cccc(C(C)Nc3nc(NC4CCOCC4)nc4c(C(C)C)cnn34)c2)C1
|
C30H40N8O3 560.703000 |
ILXGDLOHOSSAFU-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526575; PubChem:CID122517738
|
Local ready
Direct docking supported
|
|
E3L022649
BDB022649
|
BDBM526576
C=CC(=O)N1CCN(C(=O)Oc2cccc(CNc3nc(NC4CCOCC4)nc4c(C(C)C)cnn34)c2)CC1
|
C28H36N8O4 548.648000 |
HKFDRQQVSLTRAR-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526576; PubChem:CID122517760
|
Local ready
Direct docking supported
|
|
E3L022650
BDB022650
|
BDBM526577
C=CC(=O)Nc1cccc(C(=O)Nc2cccc(CNc3nc(NC4CCOCC4)nc4c(C(C)C)cnn34)c2)c1
|
C30H34N8O3 554.655000 |
VSYJBVCCOVYHPR-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526577; PubChem:CID122517818
|
Local ready
Direct docking supported
|
|
E3L022651
BDB022651
|
BDBM526578
C=CC(=O)Nc1ccccc1C(=O)Nc1cccc(CNc2nc(NC3CCOCC3)nc3c(C(C)C)cnn23)c1
|
C30H34N8O3 554.655000 |
WXYJBUJBMFEFAX-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526578; PubChem:CID122517746
|
Local ready
Direct docking supported
|
|
E3L022652
BDB022652
|
BDBM526579
CC(C)c1cnn2c(NCc3cccc(NC/C=C/C(=O)N(C)C)c3)nc(NC3CCOCC3)nc12
|
C26H36N8O2 492.628000 |
HKTODYRMUXCFAO-RMKNXTFCSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526579; PubChem:CID122517730
|
Local ready
Direct docking supported
|
|
E3L022653
BDB022653
|
BDBM526580
CCN(CC)C/C=C/C(=O)Nc1cccc(CNc2nc(NC3CCOCC3)nc3c(C(C)C)cnn23)c1
|
C28H40N8O2 520.682000 |
OKWSIRZFWUMJJC-DHZHZOJOSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526580; PubChem:CID122517715
|
Local ready
Direct docking supported
|
|
E3L022654
BDB022654
|
BDBM526581
CC(C)c1cnn2c(NCc3cccc(NC(=O)/C=C/CN4CCOCC4)c3)nc(NC3CCOCC3)nc12
|
C28H38N8O3 534.665000 |
WZFYDJKZVZOZQQ-QPJJXVBHSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526581; PubChem:CID122517805
|
Local ready
Direct docking supported
|
|
E3L022655
BDB022655
|
BDBM526582
CC(C)c1cnn2c(NCc3cccc(NC(=O)/C=C/CN(C)C)c3)nc(NC3CCOCC3)nc12
|
C26H36N8O2 492.628000 |
WOQRHKUMXBMOER-RMKNXTFCSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526582; PubChem:CID122517733
|
Local ready
Direct docking supported
|
|
E3L022656
BDB022656
|
BDBM526583
CC(C)c1cnn2c(NCc3cccc(NC(=O)/C=C/CN4CCCC4)c3)nc(NC3CCOCC3)nc12
|
C28H38N8O2 518.666000 |
TWWNLNFZVDCVGK-RMKNXTFCSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526583; PubChem:CID134281345
|
Local ready
Direct docking supported
|
|
E3L022657
BDB022657
|
BDBM526584
CC(C)c1cnn2c(NCc3cccc(NC(=O)/C=C/CN4CCCCC4)c3)nc(NC3CCOCC3)nc12
|
C29H40N8O2 532.693000 |
QKKNVJXKZQGYTA-JXMROGBWSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526584; PubChem:CID122517768
|
Local ready
Direct docking supported
|
|
E3L022658
BDB022658
|
BDBM526585
CC(C)c1cnn2c(NCc3cccc(NC(=O)/C=C/CN4CCC(F)C4)c3)nc(NC3CCOCC3)nc12
|
C28H37FN8O2 536.656000 |
LNUBFZYACACGRH-QPJJXVBHSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526585; PubChem:CID122517878
|
Local ready
Direct docking supported
|
|
E3L022659
BDB022659
|
BDBM526586
CC(C)c1cnn2c(NCc3cccc(NC(=O)/C=C/CN4CCC(F)(F)C4)c3)nc(NC3CCOCC3)nc12
|
C28H36F2N8O2 554.646000 |
QUZBDSGIBSWWNQ-QPJJXVBHSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526586; PubChem:CID122517792
|
Local ready
Direct docking supported
|
|
E3L022660
BDB022660
|
BDBM526587
CC(C)c1cnn2c(NCc3cccc(NC(=O)/C=C/CN4CCCC(F)C4)c3)nc(NC3CCOCC3)nc12
|
C29H39FN8O2 550.683000 |
RYXVGPSBEVUZKD-WEVVVXLNSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM526587; PubChem:CID122517851
|
Local ready
Direct docking supported
|