| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L018521
BDB018521
|
US10617680, Example 322
Cn1cc(-c2cnn(-c3cccc(Cl)c3C#N)c2)c(-c2cnc(NC3CC3)nc2)cc1=O
|
C23H18ClN7O 443.898000 |
PROVBWBORWUGJB-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437588; PubChem:CID135355307
|
Local ready
Direct docking supported
|
|
E3L018522
BDB018522
|
US10617680, Example 323
CCNc1ncc(-c2cc(=O)n(C)cc2-c2cnn(-c3ccccc3C#N)c2)cn1
|
C22H19N7O 397.442000 |
LRGADKFKDSBTAM-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437589; PubChem:CID135355645
|
Local ready
Direct docking supported
|
|
E3L018523
BDB018523
|
US10617680, Example 324
COCCNc1ncc(-c2cc(=O)n(C)cc2-c2cnn(-c3ccccc3C#N)c2)cn1
|
C23H21N7O2 427.468000 |
RINPLWZWUDGPGU-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437590; PubChem:CID135355284
|
Local ready
Direct docking supported
|
|
E3L018524
BDB018524
|
US10617680, Example 325
CCNc1ncc(-c2cc(=O)n(C)cc2-c2cnn(-c3cccc(Cl)c3C#N)c2)cn1
|
C22H18ClN7O 431.887000 |
BCTIJVCEDUCORZ-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437591; PubChem:CID135355480
|
Local ready
Direct docking supported
|
|
E3L018525
BDB018525
|
US10617680, Example 326
COCCNc1ncc(-c2cc(=O)n(C)cc2-c2cnn(-c3cccc(Cl)c3C#N)c2)cn1
|
C23H20ClN7O2 461.913000 |
AQUBZNJENHAPCR-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437592; PubChem:CID135355403
|
Local ready
Direct docking supported
|
|
E3L018526
BDB018526
|
US10617680, Example 327
Cn1cc(-c2cnn(-c3cccc(Cl)c3C#N)c2)c(-c2cnc(NCC3CC3)nc2)cc1=O
|
C24H20ClN7O 457.925000 |
AWBKDYANYPZJJK-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437593; PubChem:CID135355196
|
Local ready
Direct docking supported
|
|
E3L018527
BDB018527
|
US10617680, Example 328
CN(C)c1ncc(-c2cc(=O)n(C)cc2-c2cnn(-c3cccc(Cl)c3C#N)c2)cn1
|
C22H18ClN7O 431.887000 |
VEMBULFNBKYFJG-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437594; PubChem:CID135355194
|
Local ready
Direct docking supported
|
|
E3L018528
BDB018528
|
US10617680, Example 329
Cn1cc(-c2cnn(-c3cccc(Cl)c3C#N)c2)c(-c2cnc(NC3CCCC3)nc2)cc1=O
|
C25H22ClN7O 471.952000 |
HQXRBMXQODEDPA-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437595; PubChem:CID135355393
|
Local ready
Direct docking supported
|
|
E3L018529
BDB018529
|
US10617680, Example 330
Cn1cc(-c2cnn(-c3cccc(Cl)c3C#N)c2)c(-c2cnc(N3CCCC3)nc2)cc1=O
|
C24H20ClN7O 457.925000 |
DPLFLMJLSMMYIO-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437596; PubChem:CID135355406
|
Local ready
Direct docking supported
|
|
E3L018530
BDB018530
|
US10617680, Example 331
CC(C)Nc1ncc(-c2cc(=O)n(C)cc2-c2cnn(-c3cccc(Cl)c3C#N)c2)cn1
|
C23H20ClN7O 445.914000 |
URQOSBPJKPVEIT-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437597; PubChem:CID135355159
|
Local ready
Direct docking supported
|
|
E3L018531
BDB018531
|
US10617680, Example 332
CNc1ncc(-c2cc(=O)n(C)cc2-c2cnn(-c3cccc(Cl)c3C#N)c2)cn1
|
C21H16ClN7O 417.860000 |
WNRKXNRNPURAIG-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437598; PubChem:CID135355527
|
Local ready
Direct docking supported
|
|
E3L018532
BDB018532
|
US10617680, Example 333
CCNc1ncc(-c2cc(=O)n(C)cc2-c2cnn(-c3cccc(F)c3C#N)c2)cn1
|
C22H18FN7O 415.432000 |
JEFIWALCORGOJL-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437599; PubChem:CID135355397
|
Local ready
Direct docking supported
|
|
E3L018533
BDB018533
|
US10617680, Example 334
CN(C)c1ncc(-c2cc(=O)n(C)cc2-c2cnn(-c3cccc(F)c3C#N)c2)cn1
|
C22H18FN7O 415.432000 |
PIJSTBPLLHJRCY-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437600; PubChem:CID135355139
|
Local ready
Direct docking supported
|
|
E3L018534
BDB018534
|
US10617680, Example 335
Cn1cc(-c2cnn(-c3cccc(Cl)c3C#N)c2)c(-c2cnc(N3CCOCC3)nc2)cc1=O
|
C24H20ClN7O2 473.924000 |
WQAOKTLAMXTRBM-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437601; PubChem:CID135355424
|
Local ready
Direct docking supported
|
|
E3L018535
BDB018535
|
US10617680, Example 336
Cn1cc(-c2cnn(-c3cccc(F)c3C#N)c2)c(-c2cnc(N3CCCC3)nc2)cc1=O
|
C24H20FN7O 441.470000 |
POIXCJGOIHKSFM-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437602; PubChem:CID135355331
|
Local ready
Direct docking supported
|
|
E3L018536
BDB018536
|
US10617680, Example 337
CN1CCN(c2ncc(-c3cc(=O)n(C)cc3-c3cnn(-c4cccc(Cl)c4C#N)c3)cn2)CC1
|
C25H23ClN8O 486.967000 |
NBQPWOJODLVTFL-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437603; PubChem:CID135355038
|
Local ready
Direct docking supported
|
|
E3L018537
BDB018537
|
US10617680, Example 338
Cn1cc(-c2cnn(-c3cccc(Cl)c3C#N)c2)c(-c2cnc(N3CCCCC3)nc2)cc1=O
|
C25H22ClN7O 471.952000 |
JOTYWDBOKWNPRP-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437604; PubChem:CID135355308
|
Local ready
Direct docking supported
|
|
E3L018538
BDB018538
|
US10617680, Example 339
CC(C)Nc1ccc(-c2cc(=O)n(C)cc2-c2cnn(-c3cccc(Cl)c3C#N)c2)cn1
|
C24H21ClN6O 444.926000 |
NMHZRNWYVZAGLC-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437605; PubChem:CID135355142
|
Local ready
Direct docking supported
|
|
E3L018539
BDB018539
|
US10617680, Example 340
Cn1cc(-c2cnn(-c3cccc(Cl)c3C#N)c2)c(-c2ccc(NC3CCCC3)nc2)cc1=O
|
C26H23ClN6O 470.964000 |
BYOCWONXXIJAPO-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437606; PubChem:CID135355569
|
Local ready
Direct docking supported
|
|
E3L018540
BDB018540
|
US10617680, Example 341
CNc1ccc(-c2cc(=O)n(C)cc2-c2cnn(-c3cccc(Cl)c3C#N)c2)cn1
|
C22H17ClN6O 416.872000 |
AFGKFFSNVWAXDV-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM437607; PubChem:CID135355343
|
Local ready
Direct docking supported
|