| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L021001
BDB021001
|
US11058688, Example 31
CNC(=O)c1nc(-c2ccc3c(c2)c(-c2cnn(C)c2)nn3C)c2n1CCN(C(C)=O)C2
|
C22H24N8O2 432.488000 |
ZWRNEPFDQBOZIJ-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511330; PubChem:CID139530398
|
Local ready
Direct docking supported
|
|
E3L021002
BDB021002
|
US11058688, Example 32
CC(=O)N1CCn2c(Cl)nc(-c3ccc4c(c3)c(-c3cnn(C)c3)nn4C)c2C1
|
C20H20ClN7O 409.881000 |
CIDOMNLJGCBFRO-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511331; PubChem:CID139530335
|
Local ready
Direct docking supported
|
|
E3L021003
BDB021003
|
US11058688, Example 33
CNC(=O)N1CCn2c(C3CC3)nc(N3CCCc4cc(-c5cnn(C)c5)c(C(F)(F)F)cc43)c2C1
|
C25H28F3N7O 499.541000 |
CEMUSZSUHRPUMY-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511332; PubChem:CID139543406
|
Local ready
Direct docking supported
|
|
E3L021004
BDB021004
|
US11058688, Example 34
CNC(=O)N1CCn2c(C3CC3)nc(-c3cccc4nc(-c5cnn(C)c5)c(C(F)F)cc34)c2C1
|
C25H25F2N7O 477.519000 |
LBVAOMCVLLPPTH-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511333; PubChem:CID139530449
|
Local ready
Direct docking supported
|
|
E3L021005
BDB021005
|
US11058688, Example 35
CC(=O)N1CCn2c(C3CC3)nc(N3CCCc4cc(-c5ccc(C(N)=O)cc5)ccc43)c2C1
|
C27H29N5O2 455.562000 |
JZAPPWOYVOPMJR-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511334; PubChem:CID139530402
|
Local ready
Direct docking supported
|
|
E3L021006
BDB021006
|
US11058688, Example 36
CNC(=O)N1CCn2c(C3CC3)nc(-c3ccnc4nc(-c5cnn(C)c5)c(C(F)F)cc34)c2C1
|
C24H24F2N8O 478.507000 |
MFPGDLIFIOVDTR-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511335; PubChem:CID139530314
|
Local ready
Direct docking supported
|
|
E3L021007
BDB021007
|
US11058688, Example 37
CNC(=O)N1CCn2c(C3CC3)nc(-c3cccc4nc(-c5cnn(C)c5)ncc34)c2C1
|
C23H24N8O 428.500000 |
VTNXOKKCUDRHDH-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511336; PubChem:CID139530328
|
Local ready
Direct docking supported
|
|
E3L021008
BDB021008
|
US11058688, Example 38
CNC(=O)N1CCn2c(C3CC3)nc(-c3c[nH]c4cc(-c5cnn(C)c5)ncc34)c2C1
|
C22H24N8O 416.489000 |
ZWYOBOPPMNXIQR-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511337; PubChem:CID139530307
|
Local ready
Direct docking supported
|
|
E3L021009
BDB021009
|
US11058688, Example 39
CNC(=O)N1CCn2c(C3CC3)nc(-c3csc4cc(-c5cnn(C)c5)ncc34)c2C1
|
C22H23N7OS 433.541000 |
BAGBRBARIVNOHX-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511338; PubChem:CID139530313
|
Local ready
Direct docking supported
|
|
E3L021010
BDB021010
|
US11058688, Example 40
CNC(=O)N1CCn2c(C3CC3)nc(-c3cncc4cc(-c5cnn(C)c5)c(C(F)F)cc34)c2C1
|
C25H25F2N7O 477.519000 |
SGODTSWKPWAPLO-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511339; PubChem:CID139530401
|
Local ready
Direct docking supported
|
|
E3L021011
BDB021011
|
US11058688, Example 41
CC(=O)N1CCn2c(C3CC3)nc(-c3ccc(N)c(OC(F)(F)F)c3)c2C1
|
C18H19F3N4O2 380.370000 |
HPFSUIYFARAFAI-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511340; PubChem:CID139543418
|
Local ready
Direct docking supported
|
|
E3L021012
BDB021012
|
US11058688, Example 42
COc1ccc(-c2nc(C3CC3)n3c2CN(C(C)=O)CC3)cc1CO
|
C19H23N3O3 341.411000 |
NPLHDZCOLIXXHX-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511341; PubChem:CID153436813
|
Local ready
Direct docking supported
|
|
E3L021013
BDB021013
|
US11058688, Example 43
CC(=O)N1CCn2c(C3CC3)nc(-c3ccc4c(cnn4C)c3)c2C1
|
C19H21N5O 335.411000 |
QSEOUKGRWHEPKP-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511342; PubChem:CID139530364
|
Local ready
Direct docking supported
|
|
E3L021014
BDB021014
|
US11058688, Example 45
CC(=O)N1CCn2c(C3CC3)nc(-c3ccc4c(-c5cnn(C)c5)nn(C)c4c3)c2C1
|
C23H25N7O 415.501000 |
CDUWVBTZSCBATG-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511344; PubChem:CID139543518
|
Local ready
Direct docking supported
|
|
E3L021015
BDB021015
|
US11058688, Example 46
CC(=O)N1CCn2c(C3CCC3)nc(-c3ccc4c(c3)c(-c3cnn(C)c3)nn4C)c2C1
|
C24H27N7O 429.528000 |
APYYYUBPUQVMST-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511345; PubChem:CID139530334
|
Local ready
Direct docking supported
|
|
E3L021016
BDB021016
|
US11058688, Example 47
CC(=O)N1CCn2c(C)nc(-c3ccc4c(c3)c(-c3cnn(C)c3)nn4C)c2C1
|
C21H23N7O 389.463000 |
IBWLKBUSZLVGMO-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511346; PubChem:CID139530415
|
Local ready
Direct docking supported
|
|
E3L021017
BDB021017
|
US11058688, Example 48
CNC(=O)N1CCn2c(C)nc(-c3ccc4c(c3)c(-c3cnn(C)c3)nn4C)c2C1
|
C21H24N8O 404.478000 |
PUQAGYMLILNWEP-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511347; PubChem:CID139530467
|
Local ready
Direct docking supported
|
|
E3L021018
BDB021018
|
US11058688, Example 49
CC(=O)N1CCn2c(C(C)C)nc(-c3ccc4c(c3)c(-c3cnn(C)c3)nn4C)c2C1
|
C23H27N7O 417.517000 |
PJYZIPVYIULXST-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511348; PubChem:CID139530311
|
Local ready
Direct docking supported
|
|
E3L021019
BDB021019
|
US11058688, Example 50
CNC(=O)N1CCn2c(C(C)C)nc(-c3ccc4c(c3)c(-c3cnn(C)c3)nn4C)c2C1
|
C23H28N8O 432.532000 |
ZPBXIFIPWXIMHU-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511349; PubChem:CID139530468
|
Local ready
Direct docking supported
|
|
E3L021020
BDB021020
|
US11058688, Example 51
CC(=O)N1CCn2c(C3CCNCC3)nc(-c3ccc4c(c3)c(-c3cnn(C)c3)nn4C)c2C1
|
C25H30N8O 458.570000 |
SYJHAMALTLCSRR-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM511350; PubChem:CID139530459
|
Local ready
Direct docking supported
|