| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L024261
BDB024261
|
US11274090, Example 78 Isomer 1
Cc1cn(-c2ccc(NC(=O)[C@@H](NCCc3ccc(C#N)cc3)c3ccccc3)nc2)nn1
|
C25H23N7O 437.507000 |
DXVVLCWARAQCAD-DEOSSOPVSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542248; PubChem:CID139426130
|
Local ready
Direct docking supported
|
|
E3L024262
BDB024262
|
US11274090, Example 78 Isomer 2
Cc1cn(-c2ccc(NC(=O)C(NCCc3ccc(C#N)cc3)c3ccccc3)nc2)nn1
|
C25H23N7O 437.507000 |
DXVVLCWARAQCAD-UHFFFAOYSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542249; PubChem:CID139426251
|
Local ready
Direct docking supported
|
|
E3L024263
BDB024263
|
US11274090, Example 79 Isomer 1
Cn1cc(-c2ccc(NC(=O)[C@@H](NCCc3ccc(C#N)cc3)c3cccc(Cl)c3)nc2)cn1
|
C26H23ClN6O 470.964000 |
ULOQHQBQBLIAOI-VWLOTQADSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542250; PubChem:CID139426126
|
Local ready
Direct docking supported
|
|
E3L024264
BDB024264
|
US11274090, Example 79 Isomer 2
Cn1cc(-c2ccc(NC(=O)[C@H](NCCc3ccc(C#N)cc3)c3cccc(Cl)c3)nc2)cn1
|
C26H23ClN6O 470.964000 |
ULOQHQBQBLIAOI-RUZDIDTESA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542251; PubChem:CID156273081
|
Local ready
Direct docking supported
|
|
E3L024265
BDB024265
|
US11274090, Example 80 Isomer 1
N#Cc1ccc(CCN[C@H](C(=O)Nc2ccc(N3CC4(COC4)C3)cn2)c2ccccc2)cc1
|
C27H27N5O2 453.546000 |
IJRFSTAESQHIEC-VWLOTQADSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542252; PubChem:CID164515073
|
Local ready
Direct docking supported
|
|
E3L024266
BDB024266
|
US11274090, Example 80 Isomer 2
N#Cc1ccc(CCN[C@@H](C(=O)Nc2ccc(N3CC4(COC4)C3)cn2)c2ccccc2)cc1
|
C27H27N5O2 453.546000 |
IJRFSTAESQHIEC-RUZDIDTESA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542253; PubChem:CID156273083
|
Local ready
Direct docking supported
|
|
E3L024267
BDB024267
|
US11274090, Example 81 Isomer 1
N#Cc1ccc(CCN[C@H](C(=O)Nc2ccc(N3CCOCC3)cn2)c2ccccc2)cc1
|
C26H27N5O2 441.535000 |
FVFKQLNLCCBAKH-VWLOTQADSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542254; PubChem:CID139426117
|
Local ready
Direct docking supported
|
|
E3L024268
BDB024268
|
US11274090, Example 81 Isomer 2
N#Cc1ccc(CCN[C@@H](C(=O)Nc2ccc(N3CCOCC3)cn2)c2ccccc2)cc1
|
C26H27N5O2 441.535000 |
FVFKQLNLCCBAKH-RUZDIDTESA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542255; PubChem:CID156273045
|
Local ready
Direct docking supported
|
|
E3L024269
BDB024269
|
US11274090, Example 82 Isomer 1
C[C@@H](CN[C@@H](C(=O)Nc1ccc(-c2cnn(C)c2)cc1)c1ccccc1)c1ccc(C#N)cc1
|
C28H27N5O 449.558000 |
KVTFERYTBOBMTD-CCLHPLFOSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542256; PubChem:CID156293831
|
Local ready
Direct docking supported
|
|
E3L024270
BDB024270
|
US11274090, Example 82 Isomer 2
C[C@H](CN[C@@H](C(=O)Nc1ccc(-c2cnn(C)c2)cc1)c1ccccc1)c1ccc(C#N)cc1
|
C28H27N5O 449.558000 |
KVTFERYTBOBMTD-NFQMXDRXSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542257; PubChem:CID156293394
|
Local ready
Direct docking supported
|
|
E3L024271
BDB024271
|
US11274090, Example 82 Isomer 3
C[C@@H](CN[C@H](C(=O)Nc1ccc(-c2cnn(C)c2)cc1)c1ccccc1)c1ccc(C#N)cc1
|
C28H27N5O 449.558000 |
KVTFERYTBOBMTD-DCFHFQCYSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542258; PubChem:CID139426140
|
Local ready
Direct docking supported
|
|
E3L024272
BDB024272
|
US11274090, Example 82 Isomer 4
C[C@H](CN[C@H](C(=O)Nc1ccc(-c2cnn(C)c2)cc1)c1ccccc1)c1ccc(C#N)cc1
|
C28H27N5O 449.558000 |
KVTFERYTBOBMTD-HRFSGMKKSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542259; PubChem:CID139426210
|
Local ready
Direct docking supported
|
|
E3L024273
BDB024273
|
US11274090, Example 83 Isomer 1
C[C@@H](CN[C@@H](C(=O)Nc1ccc(-c2cnn(CC(F)(F)F)c2)cn1)c1ccccc1)c1ccc(C#N)cc1
|
C28H25F3N6O 518.543000 |
GQFSVNLGRMZKRE-AFMDSPMNSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542260; PubChem:CID156293829
|
Local ready
Direct docking supported
|
|
E3L024274
BDB024274
|
US11274090, Example 83 Isomer 2
C[C@H](CN[C@@H](C(=O)Nc1ccc(-c2cnn(CC(F)(F)F)c2)cn1)c1ccccc1)c1ccc(C#N)cc1
|
C28H25F3N6O 518.543000 |
GQFSVNLGRMZKRE-NIYFSFCBSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542261; PubChem:CID156293832
|
Local ready
Direct docking supported
|
|
E3L024275
BDB024275
|
US11274090, Example 83 Isomer 3
C[C@@H](CN[C@H](C(=O)Nc1ccc(-c2cnn(CC(F)(F)F)c2)cn1)c1ccccc1)c1ccc(C#N)cc1
|
C28H25F3N6O 518.543000 |
GQFSVNLGRMZKRE-SIBVEZHUSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542262; PubChem:CID164515074
|
Local ready
Direct docking supported
|
|
E3L024276
BDB024276
|
US11274090, Example 83 Isomer 4
C[C@H](CN[C@H](C(=O)Nc1ccc(-c2cnn(CC(F)(F)F)c2)cn1)c1ccccc1)c1ccc(C#N)cc1
|
C28H25F3N6O 518.543000 |
GQFSVNLGRMZKRE-BCHFMIIMSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542263; PubChem:CID139426214
|
Local ready
Direct docking supported
|
|
E3L024277
BDB024277
|
US11274090, Example 84 Isomer 1
C[C@@H](CN[C@@H](C(=O)Nc1ccc(-c2cnn(CC(=O)N(C)C)c2)cn1)c1ccccc1)c1ccc(C#N)cc1
|
C30H31N7O2 521.625000 |
SLLSXTCCPRVUIS-KCWXNJEJSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542264; PubChem:CID156293354
|
Local ready
Direct docking supported
|
|
E3L024278
BDB024278
|
US11274090, Example 84 Isomer 2
C[C@H](CN[C@@H](C(=O)Nc1ccc(-c2cnn(CC(=O)N(C)C)c2)cn1)c1ccccc1)c1ccc(C#N)cc1
|
C30H31N7O2 521.625000 |
SLLSXTCCPRVUIS-ONOMSOESSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542265; PubChem:CID156293357
|
Local ready
Direct docking supported
|
|
E3L024279
BDB024279
|
US11274090, Example 85 Isomer 1
Cn1cc(-c2ccc(NC(=O)[C@@H](NCCc3ccc(C#N)c(F)c3)c3ccccc3)nc2)cn1
|
C26H23FN6O 454.509000 |
JQUVEZMDQGIRKO-VWLOTQADSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542266; PubChem:CID139426216
|
Local ready
Direct docking supported
|
|
E3L024280
BDB024280
|
US11274090, Example 85 Isomer 2
Cn1cc(-c2ccc(NC(=O)[C@H](NCCc3ccc(C#N)c(F)c3)c3ccccc3)nc2)cn1
|
C26H23FN6O 454.509000 |
JQUVEZMDQGIRKO-RUZDIDTESA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542267; PubChem:CID156273010
|
Local ready
Direct docking supported
|