| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L043041
BDB043041
|
BDBM788170
COc1cccc2nc(CNc3cc(NC[C@H]4CCNC[C@@H]4O)nc4c(C5CC5)cnn34)cn12
|
C24H30N8O2 462.558000 |
RZTSBGXHEPIKKP-APWZRJJASA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM788170; PubChem:CID156525061
|
Local ready
Direct docking supported
|
|
E3L043042
BDB043042
|
BDBM788171
O[C@H]1CNCC[C@@H]1CNc1cc(NCc2cn3nc(C4CC4)ccc3n2)n2ncc(C3CC3)c2n1
|
C25H31N9O 473.585000 |
MSYNMXNFMHYBAH-UTKZUKDTSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM788171; PubChem:CID156525413
|
Local ready
Direct docking supported
|
|
E3L043043
BDB043043
|
BDBM788172
Cc1cccn2cc(CNc3cc(NC[C@H]4CCNC[C@@H]4O)nc4c(C5CCC5)cnn34)nc12
|
C25H32N8O 460.586000 |
XTXWZGKDTWJSRC-NQIIRXRSSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM788172; PubChem:CID156525063
|
Local ready
Direct docking supported
|
|
E3L043044
BDB043044
|
BDBM788173
O[C@H]1CNCC[C@@H]1CNc1cc(NCc2cn3c(C4CC4)cccc3n2)n2ncc(C3CC3)c2n1
|
C26H32N8O 472.597000 |
OFFUMIIHKYXTSP-GCJKJVERSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM788173; PubChem:CID156525064
|
Local ready
Direct docking supported
|
|
E3L043045
BDB043045
|
BDBM788174
CCc1cnn2c(NCc3cn4c(C)cccc4n3)cc(NC[C@H]3CCNC[C@@H]3O)nc12
|
C23H30N8O 434.548000 |
DJVOZTIAMKTHQX-MJGOQNOKSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM788174; PubChem:CID156525317
|
Local ready
Direct docking supported
|
|
E3L043046
BDB043046
|
BDBM788175
Cc1cc(C)n2cc(CNc3cc(NC[C@H]4CCNC[C@@H]4O)nc4c(C5CC5)cnn34)nc2c1
|
C25H32N8O 460.586000 |
SKSYGGOBCXCRNA-NQIIRXRSSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM788175; PubChem:CID156525068
|
Local ready
Direct docking supported
|
|
E3L043047
BDB043047
|
BDBM788176
O[C@H]1CNCC[C@@H]1CNc1cc(NCc2cn3cc(C(F)(F)F)cc(Cl)c3n2)n2ncc(C3CC3)c2n1
|
C24H26ClF3N8O 534.974000 |
BJFTYNLKNQNSGN-KUHUBIRLSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM788176; PubChem:CID156525314
|
Local ready
Direct docking supported
|
|
E3L043048
BDB043048
|
BDBM788177
CCc1cnn2c(NCc3cn4c(C(F)(F)F)cccc4n3)cc(NC[C@H]3CCNC[C@@H]3O)nc12
|
C23H27F3N8O 488.518000 |
AXTNZYFHNOPPBL-WBVHZDCISA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM788177; PubChem:CID156525315
|
Local ready
Direct docking supported
|
|
E3L043049
BDB043049
|
BDBM788178
O[C@H]1CNCC[C@@H]1CNc1cc(NCc2cn3ccc(C(F)(F)F)cc3n2)n2ncc(C3CC3)c2n1
|
C24H27F3N8O 500.529000 |
FAHSBSFAKSSWOV-BEFAXECRSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM788178; PubChem:CID156525288
|
Local ready
Direct docking supported
|
|
E3L043050
BDB043050
|
BDBM788179
Cn1c(CNc2cc(NC[C@H]3CCNC[C@@H]3O)nc3c(C4CC4)cnn23)nc2cc(F)c(F)cc21
|
C24H28F2N8O 482.539000 |
AYBBOMZSQKVNHY-VLIAUNLRSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM788179; PubChem:CID156525067
|
Local ready
Direct docking supported
|
|
E3L043051
BDB043051
|
BDBM788180
O[C@H]1CNCC[C@@H]1CNc1cc(NCc2cn3c(C(F)(F)F)cccc3n2)n2ncc(C3CC3)c2n1
|
C24H27F3N8O 500.529000 |
CDYKZMBMURUOQF-QAPCUYQASA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM788180; PubChem:CID156525373
|
Local ready
Direct docking supported
|
|
E3L043052
BDB043052
|
BDBM788181
CCc1cnn2c(NCc3cn4cc(C5CC5)cc(C(F)(F)F)c4n3)cc(NC[C@H]3CCNC[C@@H]3O)nc12
|
C26H31F3N8O 528.583000 |
MQFWMRUXMHZFJY-UTKZUKDTSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM788181; PubChem:CID156525374
|
Local ready
Direct docking supported
|
|
E3L043053
BDB043053
|
BDBM788182
Cc1cc(C(F)(F)F)cc2nc(CNc3cc(NC[C@H]4CCNC[C@@H]4O)nc4c(C5CC5)cnn34)cn12
|
C25H29F3N8O 514.556000 |
DPUZISDJEUJXIX-UZLBHIALSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM788182; PubChem:CID156525051
|
Local ready
Direct docking supported
|
|
E3L043054
BDB043054
|
BDBM788183
Cc1cn2cc(CNc3cc(NC[C@H]4CCNC[C@@H]4O)nc4c(C5CC5)cnn34)nc2cc1C(F)(F)F
|
C25H29F3N8O 514.556000 |
MPOQXAVMLPMUOR-UZLBHIALSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM788183; PubChem:CID156525052
|
Local ready
Direct docking supported
|
|
E3L043055
BDB043055
|
BDBM788184
CC(C)Oc1cccc2nc(CNc3cc(NC[C@H]4CCNC[C@@H]4O)nc4c(C5CC5)cnn34)cn12
|
C26H34N8O2 490.612000 |
LTAGOATXIZNEBT-NQIIRXRSSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM788184; PubChem:CID156525053
|
Local ready
Direct docking supported
|
|
E3L043056
BDB043056
|
BDBM788185
O[C@H]1CNCC[C@@H]1CNc1cc(NCc2cn3cc(C4CC4)cc(C(F)(F)F)c3n2)n2ncc(C3CC3)c2n1
|
C27H31F3N8O 540.594000 |
YSBRIBLSJMVUGS-VGSWGCGISA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM788185; PubChem:CID156525054
|
Local ready
Direct docking supported
|
|
E3L043057
BDB043057
|
BDBM788186
Cc1cc(C)n2cc(CNc3cc(NC[C@H]4CCNC[C@@H]4O)nc4c(C(C)C)cnn34)nc2n1
|
C24H33N9O 463.590000 |
ZRVMIIBSDSMIEO-XLIONFOSSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM788186; PubChem:CID156525069
|
Local ready
Direct docking supported
|
|
E3L043058
BDB043058
|
BDBM788187
CC(C)c1cnn2c(NCc3nc4cc(C5CC5)ccn4n3)cc(NC[C@H]3CCNC[C@@H]3O)nc12
|
C25H33N9O 475.601000 |
RXLOGDAYDFDLGX-QUCCMNQESA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM788187; PubChem:CID156526107
|
Local ready
Direct docking supported
|
|
E3L043059
BDB043059
|
BDBM788188
O[C@H]1CNCC[C@@H]1CNc1cc(NCc2cn3ccc(-c4ccccc4)cc3n2)n2ncc(C3CC3)c2n1
|
C29H32N8O 508.630000 |
RPJBXXVLFGLSLU-RDGATRHJSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM788188; PubChem:CID156790917
|
Local ready
Direct docking supported
|
|
E3L043060
BDB043060
|
BDBM788822
CCN(C(=O)c1cc(F)ccc1Oc1nncnc1N1CCC2(C1)CN([C@H](CCCNCC(OC)OC)C(C)C)C2)C(C)C
|
C32H50FN7O4 615.795000 |
AQZWMVOSOMUJET-AREMUKBSSA-N | Q03164 | Histone-lysine N-methyltransferase 2A |
BindingDB, PubChem
BindingDB:BDBM788822; PubChem:CID156497978
|
Local ready
Direct docking supported
|