| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L024361
BDB024361
|
US11274090, Example 115 Isomer 1
Cc1cc(NC(=O)[C@H](NC[C@H](C)c2ccc(C#N)cc2)c2ccccc2)ncc1-c1cnn(C)c1
|
C28H28N6O 464.573000 |
JLOBUWYUTRHNAK-CCLHPLFOSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542349; PubChem:CID164515090
|
Local ready
Direct docking supported
|
|
E3L024362
BDB024362
|
US11274090, Example 115 Isomer 2
Cc1cc(NC(=O)[C@H](NC[C@@H](C)c2ccc(C#N)cc2)c2ccccc2)ncc1-c1cnn(C)c1
|
C28H28N6O 464.573000 |
JLOBUWYUTRHNAK-NFQMXDRXSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542350; PubChem:CID156293826
|
Local ready
Direct docking supported
|
|
E3L024363
BDB024363
|
US11274090, Example 116 Isomer 1
Cn1cc(-c2ccc(NC(=O)[C@@H](NCCc3ccc(C#N)cc3)c3cccc(C#N)c3)nc2)cn1
|
C27H23N7O 461.529000 |
LJVXAQUTCFSHEV-SANMLTNESA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542351; PubChem:CID139426055
|
Local ready
Direct docking supported
|
|
E3L024364
BDB024364
|
US11274090, Example 116 Isomer 2
Cn1cc(-c2ccc(NC(=O)[C@H](NCCc3ccc(C#N)cc3)c3cccc(C#N)c3)nc2)cn1
|
C27H23N7O 461.529000 |
LJVXAQUTCFSHEV-AREMUKBSSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542352; PubChem:CID156273064
|
Local ready
Direct docking supported
|
|
E3L024365
BDB024365
|
US11274090, Example 117 Isomer 1
Cn1cc(-c2ccc(NC(=O)[C@@H](NCCc3ccc(C#N)cc3)c3cccc(C(F)(F)F)c3)nc2)cn1
|
C27H23F3N6O 504.516000 |
QOAHVGWTBGWUQN-VWLOTQADSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542353; PubChem:CID139425902
|
Local ready
Direct docking supported
|
|
E3L024366
BDB024366
|
US11274090, Example 117 Isomer 2
Cn1cc(-c2ccc(NC(=O)[C@H](NCCc3ccc(C#N)cc3)c3cccc(C(F)(F)F)c3)nc2)cn1
|
C27H23F3N6O 504.516000 |
QOAHVGWTBGWUQN-RUZDIDTESA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542354; PubChem:CID156273067
|
Local ready
Direct docking supported
|
|
E3L024367
BDB024367
|
US11274090, Example 118 Isomer 1
CCCCCCc1cccc([C@H](NCCc2ccc(C#N)cc2)C(=O)Nc2ccc(-c3cnn(C)c3)cn2)c1
|
C32H36N6O 520.681000 |
UOIREGCXKYILFI-HKBQPEDESA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542355; PubChem:CID139425903
|
Local ready
Direct docking supported
|
|
E3L024368
BDB024368
|
US11274090, Example 118 Isomer 2
CCCCCCc1cccc([C@@H](NCCc2ccc(C#N)cc2)C(=O)Nc2ccc(-c3cnn(C)c3)cn2)c1
|
C32H36N6O 520.681000 |
UOIREGCXKYILFI-WJOKGBTCSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542356; PubChem:CID156273082
|
Local ready
Direct docking supported
|
|
E3L024369
BDB024369
|
US11274090, Example 119 Isomer 1
Cn1cc(-c2ccc(NC(=O)[C@@H](NCCc3ccc(C#N)cc3)c3ccc(C#N)cc3)nc2)cn1
|
C27H23N7O 461.529000 |
YFRRCFOQXGRQFT-SANMLTNESA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542357; PubChem:CID139425916
|
Local ready
Direct docking supported
|
|
E3L024370
BDB024370
|
US11274090, Example 119 Isomer 2
Cn1cc(-c2ccc(NC(=O)[C@H](NCCc3ccc(C#N)cc3)c3ccc(C#N)cc3)nc2)cn1
|
C27H23N7O 461.529000 |
YFRRCFOQXGRQFT-AREMUKBSSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542358; PubChem:CID156273043
|
Local ready
Direct docking supported
|
|
E3L024371
BDB024371
|
US11274090, Example 120 Isomer 1
Cn1cc(-c2ccc(NC(=O)[C@@H](NCCc3ccc(C#N)cc3)c3ccc(C(F)(F)F)cc3)nc2)cn1
|
C27H23F3N6O 504.516000 |
IPQPHKLIQXNMEQ-VWLOTQADSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542359; PubChem:CID139425900
|
Local ready
Direct docking supported
|
|
E3L024372
BDB024372
|
US11274090, Example 120 Isomer 2
Cn1cc(-c2ccc(NC(=O)[C@H](NCCc3ccc(C#N)cc3)c3ccc(C(F)(F)F)cc3)nc2)cn1
|
C27H23F3N6O 504.516000 |
IPQPHKLIQXNMEQ-RUZDIDTESA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542360; PubChem:CID156273053
|
Local ready
Direct docking supported
|
|
E3L024373
BDB024373
|
US11274090, Example 121-racemic
CCCCCCc1ccc(C(NCCc2ccc(C#N)cc2)C(=O)Nc2ccc(-c3cnn(C)c3)cn2)cc1
|
C32H36N6O 520.681000 |
SYAPHKHVCLLISG-UHFFFAOYSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542361; PubChem:CID139426161
|
Local ready
Direct docking supported
|
|
E3L024374
BDB024374
|
US11274090, Example 122 Isomer 1
Cn1cc(-c2ccnc(NC(=O)[C@@H](NCCc3ccc(C#N)cc3)c3ccccc3)c2)cn1
|
C26H24N6O 436.519000 |
SJBOWATVZXVXMS-VWLOTQADSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542362; PubChem:CID139425917
|
Local ready
Direct docking supported
|
|
E3L024375
BDB024375
|
US11274090, Example 122 Isomer 2
Cn1cc(-c2ccnc(NC(=O)[C@H](NCCc3ccc(C#N)cc3)c3ccccc3)c2)cn1
|
C26H24N6O 436.519000 |
SJBOWATVZXVXMS-RUZDIDTESA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542363; PubChem:CID156273085
|
Local ready
Direct docking supported
|
|
E3L024376
BDB024376
|
US11274090, Example 123 Isomer 1
Cn1cc(-c2cccc(NC(=O)[C@@H](NCCc3ccc(C#N)cc3)c3ccccc3)n2)cn1
|
C26H24N6O 436.519000 |
QOOCBVZJFGGJGP-VWLOTQADSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542364; PubChem:CID139425901
|
Local ready
Direct docking supported
|
|
E3L024377
BDB024377
|
US11274090, Example 123 Isomer 2
Cn1cc(-c2cccc(NC(=O)[C@H](NCCc3ccc(C#N)cc3)c3ccccc3)n2)cn1
|
C26H24N6O 436.519000 |
QOOCBVZJFGGJGP-RUZDIDTESA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542365; PubChem:CID156273080
|
Local ready
Direct docking supported
|
|
E3L024378
BDB024378
|
US11274090, Example 124 Isomer 1
CC1CN(c2ccc(NC(=O)[C@H](NC[C@H](C)c3ccc(C#N)cc3)c3ccccc3)nc2)CC(=O)N1C
|
C29H32N6O2 496.615000 |
UBBRKLFXBPVIPQ-RWGQCZFRSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542366; PubChem:CID164515091
|
Local ready
Direct docking supported
|
|
E3L024379
BDB024379
|
US11274090, Example 124 Isomer 2
CC1CN(c2ccc(NC(=O)[C@H](NC[C@@H](C)c3ccc(C#N)cc3)c3ccccc3)nc2)CC(=O)N1C
|
C29H32N6O2 496.615000 |
UBBRKLFXBPVIPQ-INIWHGLXSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542367; PubChem:CID156293322
|
Local ready
Direct docking supported
|
|
E3L024380
BDB024380
|
US11274090, Example 125 Isomer 1
CC1CN(C)C(=O)CN1c1ccc(NC(=O)[C@H](NC[C@H](C)c2ccc(C#N)cc2)c2ccccc2)nc1
|
C29H32N6O2 496.615000 |
XSHDJLPLKGGMGP-RWGQCZFRSA-N | Q09472 | Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM542368; PubChem:CID164515092
|
Local ready
Direct docking supported
|