| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L012581
BDB012581
|
US9550796, Example 120
COc1ncccc1-c1c(C2CC2)c2c(n1C)C(c1ccc(Cl)cc1)N(c1cc(C)c3nnc(C)n3c1)C2=O
|
C30H27ClN6O2 539.039000 |
VQOLKEMPAJVXHY-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM274319; PubChem:CID122553424
|
Local ready
Direct docking supported
|
|
E3L012582
BDB012582
|
US9550796, Example 121
Cc1cc(N2C(=O)c3cc(C4CCOCC4)n(C)c3C2c2ccc(Cl)cc2)cn2c(C)nnc12
|
C26H26ClN5O2 475.980000 |
HXGQYSSCVKIEIA-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM274320; PubChem:CID122553481
|
Local ready
Direct docking supported
|
|
E3L012583
BDB012583
|
US9550796, Example 122
Cc1cc(N2C(=O)c3c(C4CC4)c(C)n(C)c3C2c2ccc(Cl)cc2)cn2c(C)nnc12
|
C25H24ClN5O 445.954000 |
KVPRUGZKNCVUEL-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM274321; PubChem:CID122553437
|
Local ready
Direct docking supported
|
|
E3L012584
BDB012584
|
Pyrrolo-pyrrolone derivative 5
CCOC(=O)n1c(C2=CCOCC2)c(C)c2c1C(c1ccc(Cl)cc1)N(c1cc(C)c3nnc(C)n3c1)C2=O
|
C29H28ClN5O4 546.027000 |
XQCLLKJYKDIUDW-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM274322; PubChem:CID118095173
|
Local ready
Direct docking supported
|
|
E3L012585
BDB012585
|
US9550796, Example 124
CCOC(=O)n1c(-c2cccnc2OC)c(C)c2c1C(c1ccc(Cl)cc1)N(c1cc(C)c3nnc(C)n3c1)C2=O
|
C30H27ClN6O4 571.037000 |
VBNIZIAZOQSIGW-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM274323; PubChem:CID118095217
|
Local ready
Direct docking supported
|
|
E3L012586
BDB012586
|
US9550796, Example 125
CCOC(=O)n1cc(C2CC2)c2c1C(c1ccc(Cl)cc1)N(c1cc(C)c3nnc(C)n3c1)C2=O
|
C26H24ClN5O3 489.963000 |
FZOWBAIZBAZQAF-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM274324; PubChem:CID118095183
|
Local ready
Direct docking supported
|
|
E3L012587
BDB012587
|
US9550796, Example 126
Cc1cn(C2CCN(C)C2=O)c2c1C(=O)N(c1cc(C)c3nnc(C)n3c1)C2c1ccc(Cl)cc1
|
C26H25ClN6O2 488.979000 |
WEWCBQWPGVKVPY-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM274325; PubChem:CID122553428
|
Local ready
Direct docking supported
|
|
E3L012588
BDB012588
|
US9550796, Example 127
CNC(=O)Cn1cc(C)c2c1C(c1ccc(Cl)cc1)N(c1cc(C)c3nnc(C)n3c1)C2=O
|
C24H23ClN6O2 462.941000 |
KGPRTZSROXHRIX-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM274326; PubChem:CID118095181
|
Local ready
Direct docking supported
|
|
E3L012589
BDB012589
|
US9550796, Example 128
Cc1cn(CCN(C)C)c2c1C(=O)N(c1cc(C)c3nnc(C)n3c1)C2c1ccc(Cl)cc1
|
C25H27ClN6O 462.985000 |
OFWSNGJQSBQEOU-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM274327; PubChem:CID122553476
|
Local ready
Direct docking supported
|
|
E3L012590
BDB012590
|
US9550796, Example 129
Cc1cn(CC(=O)N(C)C)c2c1C(=O)N(c1cc(C)c3nnc(C)n3c1)C2c1ccc(Cl)cc1
|
C25H25ClN6O2 476.968000 |
OJGGGCDIKGWBSR-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM274328; PubChem:CID118095225
|
Local ready
Direct docking supported
|
|
E3L012591
BDB012591
|
US9550796, Example 130
Cc1cc(N2C(=O)c3c(C4CNC4)cn(C)c3C2c2ccc(Cl)cc2)nc2c1nnn2C
|
C23H22ClN7O 447.930000 |
CRYAUTCZOKUESS-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM274329; PubChem:CID122553419
|
Local ready
Direct docking supported
|
|
E3L012592
BDB012592
|
US9550796, Example 131
Cc1cc(N2C(=O)c3ccn(C)c3C2c2ccc(Cl)cc2)nn2c(C)nnc12
|
C20H17ClN6O 392.850000 |
CURNKPOFSHNCQW-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM274330; PubChem:CID122553408
|
Local ready
Direct docking supported
|
|
E3L012593
BDB012593
|
US9550796, Example 132
CNC(=O)c1cn(C)c2c1C(=O)N(c1cc(C)c3nnc(C(F)F)n3c1)C2c1ccc(Cl)cc1
|
C23H19ClF2N6O2 484.894000 |
LDQWWSKUZGJSPQ-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM274331; PubChem:CID118095270
|
Local ready
Direct docking supported
|
|
E3L012594
BDB012594
|
US9550796, Example 133
CC(=O)Nc1cn(C)c2c1C(=O)N(c1cc(C)c3nnc(C(F)F)n3c1)C2c1ccc(Cl)cc1
|
C23H19ClF2N6O2 484.894000 |
UCOMAESNVXJEIJ-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM274332; PubChem:CID118095280
|
Local ready
Direct docking supported
|
|
E3L012595
BDB012595
|
US9550796, Example 134
Cc1cc(N2C(=O)c3c(NC(=O)CN(C)C)cn(C)c3C2c2ccc(Cl)cc2)cn2c(C(F)F)nnc12
|
C25H24ClF2N7O2 527.963000 |
FESHYOISGIZOBW-UHFFFAOYSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM274333; PubChem:CID118095176
|
Local ready
Direct docking supported
|
|
E3L012596
BDB012596
|
US9550796, Example 135
COc1ncccc1-c1cc2c(n1C)[C@H](c1ccc(Cl)cc1)N(c1cc(C)c3nnc(C)n3c1)C2=O
|
C27H23ClN6O2 498.974000 |
UQMYMWRETIHSGQ-QHCPKHFHSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM274334; PubChem:CID122553434
|
Local ready
Direct docking supported
|
|
E3L012597
BDB012597
|
US9550796, Example 136
CC(=O)Nc1cn(C)c2c1C(=O)N(c1cc(C)c3nnc(C)n3c1)[C@@H]2c1ccc(Cl)cc1
|
C23H21ClN6O2 448.914000 |
SSELZXGQLGXCDT-HXUWFJFHSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM274335; PubChem:CID118095246
|
Local ready
Direct docking supported
|
|
E3L012598
BDB012598
|
US9550796, Example 137
Cc1cc(N2C(=O)c3cc(C4=CCOCC4)n(C)c3[C@@H]2c2ccc(Cl)cc2)cn2c(C)nnc12
|
C26H24ClN5O2 473.964000 |
SMYPWBHABVYAJK-QHCPKHFHSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM274336; PubChem:CID122553471
|
Local ready
Direct docking supported
|
|
E3L012599
BDB012599
|
2-(1-methylimidazol-4-yl)-4-(1H-triazol-4-yl)pyridine
Cn1cnc(-c2cc(-c3c[nH]nn3)ccn2)c1
|
C11H10N6 226.243000 |
JMBGPAGLZBKRJX-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM276039; PubChem:CID118956738
|
Local ready
Direct docking supported
|
|
E3L012600
BDB012600
|
BDBM276040
Clc1ccccc1Cn1cnc(-c2cc(-c3c[nH]nn3)ccn2)c1
|
C17H13ClN6 336.786000 |
FEAWGCOCHKJAAI-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM276040; PubChem:CID118956748
|
Local ready
Direct docking supported
|