| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L048321
BDB048321
|
BDBM50200380
Cc1cccc(Nc2n[nH]c3c2CN(C(=O)C2CC2)CC3)c1
|
C17H20N4O 296.374000 |
QSOUCRGIBJRTAG-UHFFFAOYSA-N | Q09472, Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50200380; PubChem:CID134154313
|
Local ready
Direct docking supported
|
|
E3L048322
BDB048322
|
BDBM50200381
CC(=O)N1CCc2[nH]nc(Nc3cccc(C(F)(F)F)c3)c2C1
|
C15H15F3N4O 324.306000 |
BAHQNJLZVVLSJW-UHFFFAOYSA-N | Q09472, Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50200381; PubChem:CID134134171
|
Local ready
Direct docking supported
|
|
E3L048323
BDB048323
|
BDBM50200382
CC(=O)N1CCc2[nH]nc(Nc3ccccc3F)c2C1
|
C14H15FN4O 274.299000 |
GEGHUOMDODEYMX-UHFFFAOYSA-N | Q09472, Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50200382; PubChem:CID134151910
|
Local ready
Direct docking supported
|
|
E3L048324
BDB048324
|
BDBM50200383
CC(=O)N1CCc2c(c(Nc3cccc(-c4ccnn4C)c3)nn2CC2CC2)C1
|
C22H26N6O 390.491000 |
HLTFLEHNLNKZIT-UHFFFAOYSA-N | Q09472, Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50200383; PubChem:CID121373156
|
Local ready
Direct docking supported
|
|
E3L048325
BDB048325
|
BDBM50200384
CC(=O)N1CCc2c(c(Nc3ccc(-c4cnn(C)c4)cc3F)nn2[C@@H]2CCOC2)C1
|
C22H25FN6O2 424.480000 |
NKOJNOBJGYTLLZ-QGZVFWFLSA-N | Q09472, Q12830, Q92793, Q92831 | CREB-binding protein, Nucleosome-remodeling factor subunit BPTF, Histone acetyltransferase KAT2B, Histone acetyltransferase p300 |
BindingDB, PubChem
BindingDB:BDBM50200384; PubChem:CID121376807
|
Local ready
Direct docking supported
|
|
E3L048326
BDB048326
|
BDBM50200385
CC(=O)N1CCc2[nH]nc(Nc3ccccc3)c2C1
|
C14H16N4O 256.309000 |
ZXIJCVCJLDGJRX-UHFFFAOYSA-N | Q09472, Q12830, Q92793, Q92831 | Nucleosome-remodeling factor subunit BPTF, CREB-binding protein, Histone acetyltransferase KAT2B |
BindingDB, PubChem
BindingDB:BDBM50200385; PubChem:CID95828281
|
Local ready
Direct docking supported
|
|
E3L048327
BDB048327
|
BDBM50200386
CC(=O)N1CCc2c(c(Nc3cccc(C)c3)nn2CCC2CC2)C1
|
C20H26N4O 338.455000 |
CEPJZYYWEDIEOG-UHFFFAOYSA-N | Q09472, Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50200386; PubChem:CID134132252
|
Local ready
Direct docking supported
|
|
E3L048328
BDB048328
|
BDBM50200387
CC(=O)N1CCc2c(c(Nc3cccc(C)c3)nn2C)C1
|
C16H20N4O 284.363000 |
FEVFEDHOYMRQIZ-UHFFFAOYSA-N | Q09472, Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50200387; PubChem:CID121372897
|
Local ready
Direct docking supported
|
|
E3L048329
BDB048329
|
BDBM50200388
CC(=O)N1CCc2[nH]nc(Nc3cccc(F)c3)c2C1
|
C14H15FN4O 274.299000 |
XMANXVDMULPMRR-UHFFFAOYSA-N | Q09472, Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50200388; PubChem:CID134132771
|
Local ready
Direct docking supported
|
|
E3L048330
BDB048330
|
BDBM50200389
CC(=O)N1CCc2c(c(Nc3cccc(C)c3)nn2Cc2ccccn2)C1
|
C21H23N5O 361.449000 |
RAIPQLGDNRXVJX-UHFFFAOYSA-N | Q09472, Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50200389; PubChem:CID121372875
|
Local ready
Direct docking supported
|
|
E3L048331
BDB048331
|
BDBM50200390
CC(=O)N1CCc2c(c(Nc3cccc(-c4cn[nH]c4)c3)nn2CC2CC2)C1
|
C21H24N6O 376.464000 |
AMNYDJDEGBTNSA-UHFFFAOYSA-N | Q09472, Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50200390; PubChem:CID121373154
|
Local ready
Direct docking supported
|
|
E3L048332
BDB048332
|
BDBM50200391
CC(=O)N1CCc2c(c(Nc3cccc(C)c3)nn2CCC#N)C1
|
C18H21N5O 323.400000 |
NZAWVJDDBLNIQI-UHFFFAOYSA-N | Q09472, Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50200391; PubChem:CID121373031
|
Local ready
Direct docking supported
|
|
E3L048333
BDB048333
|
C-1368
O=C(Nc1cccc(Nc2nccc(Nc3cccc(C(F)(F)F)c3)n2)c1)C1CC1
|
C21H18F3N5O 413.403000 |
RDTDWGQDFJPTPD-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM50200392; PubChem:CID9549303
|
Local ready
Direct docking supported
|
|
E3L048334
BDB048334
|
BDBM50200393
O=C(Nc1cccc(Nc2ccnc(Nc3cccc(C(F)(F)F)c3)n2)c1)C1CC1
|
C21H18F3N5O 413.403000 |
ZJYUMCJZQBEWOW-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM50200393; PubChem:CID11589674
|
Local ready
Direct docking supported
|
|
E3L048335
BDB048335
|
EGFR inhibitor
O=C(Nc1cccc(Nc2cc(Nc3cccc(C(F)(F)F)c3)ncn2)c1)C1CC1
|
C21H18F3N5O 413.403000 |
YOHYSYJDKVYCJI-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM50200394; PubChem:CID9549299
|
Local ready
Direct docking supported
|
|
E3L048336
BDB048336
|
BDBM50200397
CC(=O)N1CCc2c(c(Nc3cccc(-c4ccccn4)c3)nn2CC2CC2)C1
|
C23H25N5O 387.487000 |
YHBKXFFZZJCTSD-UHFFFAOYSA-N | Q09472, Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50200397; PubChem:CID121373074
|
Local ready
Direct docking supported
|
|
E3L048337
BDB048337
|
BDBM50200398
CCn1nc(Nc2cccc(C)c2)c2c1CCN(C(C)=O)C2
|
C17H22N4O 298.390000 |
LPEFXYUIOKMUCW-UHFFFAOYSA-N | Q09472, Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM50200398; PubChem:CID121373206
|
Local ready
Direct docking supported
|
|
E3L048338
BDB048338
|
BDBM50200399
CCc1ccc(-c2nccc(N(C)CCCOc3ccc4c(c3)CC[C@H]4CC(=O)O)n2)cc1
|
C27H31N3O3 445.563000 |
BESRZLMEODTHCH-QFIPXVFZSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50200399; PubChem:CID44439724
|
Local ready
Direct docking supported
|
|
E3L048339
BDB048339
|
BDBM50200400
Cc1nc(-c2ccc(OCCCOc3ccc4c(c3)CC[C@H]4CC(=O)O)nc2)sc1C
|
C24H26N2O4S 438.549000 |
INSJDULTKROYCO-SFHVURJKSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50200400; PubChem:CID9980571
|
Local ready
Direct docking supported
|
|
E3L048340
BDB048340
|
BDBM50200401
Cc1cccc(-c2ncc(C)c(N(C)CCCOc3ccc4c(c3)CC[C@H]4CC(=O)O)n2)c1
|
C27H31N3O3 445.563000 |
GLYPZQJNVATZPQ-NRFANRHFSA-N | Q07869 | Peroxisome proliferator-activated receptor alpha |
BindingDB, PubChem
BindingDB:BDBM50200401; PubChem:CID44439718
|
Local ready
Direct docking supported
|