| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L027581
BDB027581
|
US11447493, Example 80
C=CC(=O)N1CCOc2cc(C(=O)N3CC[C@@H](Nc4ncc5ccccc5n4)C3)ccc21
|
C24H23N5O3 429.480000 |
ORZWXCBRFNEYDM-GOSISDBHSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM572115; PubChem:CID151378995
|
Local ready
Direct docking supported
|
|
E3L027582
BDB027582
|
US11447493, Example 81
COc1cc(C(=O)N2CC[C@@H](Nc3ncc4ccccc4n3)C2)ccc1NC(=O)/C=C/CN(C)C
|
C26H30N6O3 474.565000 |
DLVVFKMWFVZWDD-AQDCRGGLSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM572116; PubChem:CID150053771
|
Local ready
Direct docking supported
|
|
E3L027583
BDB027583
|
US11447493, Example 82
CN(C)C/C=C/C(=O)Nc1ccc(C(=O)N2CC[C@@H](Nc3ncc4ccccc4n3)C2)cc1Cl
|
C25H27ClN6O2 478.984000 |
IUJVWZRIKASHNS-MTCRFPMVSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM572117; PubChem:CID147987394
|
Local ready
Direct docking supported
|
|
E3L027584
BDB027584
|
US11447493, Example 83
Cc1cc(C(=O)N2CC[C@@H](Nc3ncc4ccccc4n3)C2)ccc1NC(=O)/C=C/CN(C)C
|
C26H30N6O2 458.566000 |
UQDLBEGORWSOQS-VHTFYLNKSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM572118; PubChem:CID152048311
|
Local ready
Direct docking supported
|
|
E3L027585
BDB027585
|
US11447493, Example 84
CN(C)C/C=C/C(=O)N1CCOc2cc(C(=O)N3CC[C@@H](Nc4ncc5ccccc5n4)C3)ccc21
|
C27H30N6O3 486.576000 |
JMVIDMZVTXZHKA-WKOQKXSESA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM572119; PubChem:CID150705792
|
Local ready
Direct docking supported
|
|
E3L027586
BDB027586
|
US11447493, Example 85
COc1cc(NC(=O)/C=C/CN(C)C)ccc1C(=O)N1CC[C@@H](Nc2ncc3ccccc3n2)C1
|
C26H30N6O3 474.565000 |
SIGKFKBFXQQJJH-AQDCRGGLSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM572120; PubChem:CID151848932
|
Local ready
Direct docking supported
|
|
E3L027587
BDB027587
|
US11447493, Example 86
CN(C)C/C=C/C(=O)N(C)c1ccc(C(=O)N2CC[C@@H](Nc3ncc4ccccc4n3)C2)cc1
|
C26H30N6O2 458.566000 |
LNYCRXZEMSCWFG-VHTFYLNKSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM572121; PubChem:CID148379919
|
Local ready
Direct docking supported
|
|
E3L027588
BDB027588
|
US11447493, Example 87
C=CC(=O)Nc1cccc(C(=O)N2CC[C@@H](Nc3ncc4ccccc4n3)C2)c1
|
C22H21N5O2 387.443000 |
XRNXDWRXNVCTGN-GOSISDBHSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM572122; PubChem:CID152441377
|
Local ready
Direct docking supported
|
|
E3L027589
BDB027589
|
US11447493, Example 88
C=CC(=O)Nc1ccc(C(=O)N2CC[C@@H](Nc3ncc4ccccc4n3)C2)cc1Cl
|
C22H20ClN5O2 421.888000 |
ONRGJWZQIHEWQH-MRXNPFEDSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM572123; PubChem:CID151356994
|
Local ready
Direct docking supported
|
|
E3L027590
BDB027590
|
US11447493, Example 89
CN(C)C/C=C/C(=O)N1CCCc2cc(C(=O)N3CC[C@@H](Nc4ncc5ccccc5n4)C3)ccc21
|
C28H32N6O2 484.604000 |
RVHAEPLNTRENOO-PQCQUMGKSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM572124; PubChem:CID146788124
|
Local ready
Direct docking supported
|
|
E3L027591
BDB027591
|
US11447493, Example 90
C=CC(=O)Nc1ccc(C(=O)N2CC[C@@H](Nc3ncc4cccc(F)c4n3)C2)cc1
|
C22H20FN5O2 405.433000 |
ILLVNLODYLPPIC-QGZVFWFLSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM572125; PubChem:CID150569130
|
Local ready
Direct docking supported
|
|
E3L027592
BDB027592
|
US11447493, Example 91
C=CC(=O)Nc1ccc(C(=O)N2CC[C@@H](Nc3ncc4c(F)cccc4n3)C2)cc1
|
C22H20FN5O2 405.433000 |
CIECLIQCGMZLNI-MRXNPFEDSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM572126; PubChem:CID149905793
|
Local ready
Direct docking supported
|
|
E3L027593
BDB027593
|
US11447493, Example 92
C=CC(=O)Nc1ccc(C(=O)N2CC[C@@H](Nc3ncc4cc(F)ccc4n3)C2)cc1C
|
C23H22FN5O2 419.460000 |
KXKAWIWAQIOGGO-GOSISDBHSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM572127; PubChem:CID150887829
|
Local ready
Direct docking supported
|
|
E3L027594
BDB027594
|
US11447493, Example 93
C=CC(=O)Nc1ccc(C(=O)N2CC[C@@H](Nc3ncc4ccc(S(C)(=O)=O)cc4n3)C2)cc1C
|
C24H25N5O4S 479.562000 |
RZAUUURMPYOKSI-GOSISDBHSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM572128; PubChem:CID151803164
|
Local ready
Direct docking supported
|
|
E3L027595
BDB027595
|
US11447493, Example 94
C=C(CC)C(=O)Nc1ccc(C(=O)N2CC[C@@H](Nc3ncc4ccccc4n3)C2)cc1
|
C24H25N5O2 415.497000 |
JKHQLEAMZNVIPI-HXUWFJFHSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM572129; PubChem:CID150693148
|
Local ready
Direct docking supported
|
|
E3L027596
BDB027596
|
US11447493, Example 95
C=CS(=O)(=O)Nc1ccc(C(=O)N2CC[C@@H](Nc3ncc4ccccc4n3)C2)cc1
|
C21H21N5O3S 423.498000 |
QSERWBXLEKAYCJ-GOSISDBHSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM572130; PubChem:CID151639378
|
Local ready
Direct docking supported
|
|
E3L027597
BDB027597
|
US11447493, Example 96
C=CC(=O)Nc1ccc(C(=O)N2C[C@H](Nc3ncc4ccccc4n3)[C@@H](C)C2)cc1
|
C23H23N5O2 401.470000 |
GRBMJJYBCNETMC-YWZLYKJASA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM572131; PubChem:CID150337889
|
Local ready
Direct docking supported
|
|
E3L027598
BDB027598
|
US11458138, Example 1
CC(C)(Nc1nc(-c2ccncc2)nc2cnccc12)C1CC1
|
C18H19N5 305.385000 |
OJKBHNAVTDJSIO-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM573837; PubChem:CID145744625
|
Local ready
Direct docking supported
|
|
E3L027599
BDB027599
|
US11458138, Example 2
CCN(CC)c1nc(-c2ccncc2)nc2cnccc12
|
C16H17N5 279.347000 |
PGOCRNZIASOKRK-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM573863; PubChem:CID135368321
|
Local ready
Direct docking supported
|
|
E3L027600
BDB027600
|
US11458138, Example 3
CCN(c1nc(-c2ccncc2)nc2cnccc12)C(C)C
|
C17H19N5 293.374000 |
MGSXOJRYNIPSTE-UHFFFAOYSA-N | O95835 | Serine/threonine-protein kinase LATS1 |
BindingDB, PubChem
BindingDB:BDBM573866; PubChem:CID145744578
|
Local ready
Direct docking supported
|