| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L012861
BDB012861
|
US10022354, Example 117
CC(C)c1cc(C(=O)N2CC[C@H](NC(=O)c3ccccc3)C2)[nH]n1
|
C18H22N4O2 326.400000 |
RNQBSNIBYKAZGI-AWEZNQCLSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281177; PubChem:CID132070191
|
Local ready
Direct docking supported
|
|
E3L012862
BDB012862
|
US10022354, Example 118
CC(C)c1cc(C(=O)N2CCC(NC(=O)C3CNC3)C2)[nH]n1
|
C15H23N5O2 305.382000 |
OBBMJJQURWIWOA-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281178; PubChem:CID121279640
|
Local ready
Direct docking supported
|
|
E3L012863
BDB012863
|
US10022354, Example 119
CC(C)c1cc(C(=O)N2CCC(NC(=O)C3CCNC3)C2)[nH]n1
|
C16H25N5O2 319.409000 |
CQXIGWIEEDRMKV-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281179; PubChem:CID121279591
|
Local ready
Direct docking supported
|
|
E3L012864
BDB012864
|
US10022354, Example 120
CC(C)c1cc(C(=O)N2CCC(NC(=O)c3ccc4cc[nH]c4c3)C2)[nH]n1
|
C20H23N5O2 365.437000 |
QHEGYMNPXHQSPZ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281180; PubChem:CID121279597
|
Local ready
Direct docking supported
|
|
E3L012865
BDB012865
|
US10022354, Example 121
CC(C)c1cc(C(=O)N2CCC(NC(=O)c3ccc4[nH]ccc4c3)C2)[nH]n1
|
C20H23N5O2 365.437000 |
HBQFJGVIVUPJPF-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281181; PubChem:CID121279593
|
Local ready
Direct docking supported
|
|
E3L012866
BDB012866
|
US10022354, Example 122
CC(C)c1cc(C(=O)N2CCC(NC(=O)c3cc4ccccc4[nH]3)C2)[nH]n1
|
C20H23N5O2 365.437000 |
JBVHNAQTALBJAD-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281182; PubChem:CID121279617
|
Local ready
Direct docking supported
|
|
E3L012867
BDB012867
|
US10022354, Example 123
CCC(=O)NC1CCN(C(=O)c2cc(C(C)C)n[nH]2)C1
|
C14H22N4O2 278.356000 |
MGXMSHAYYGXJLQ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281183; PubChem:CID121279532
|
Local ready
Direct docking supported
|
|
E3L012868
BDB012868
|
US10022354, Example 124
CCCC(=O)NC1CCN(C(=O)c2cc(C(C)C)n[nH]2)C1
|
C15H24N4O2 292.383000 |
OLFMDZINSHQFQJ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281184; PubChem:CID121279533
|
Local ready
Direct docking supported
|
|
E3L012869
BDB012869
|
US10022354, Example 125
CC(C)CC(=O)NC1CCN(C(=O)c2cc(C(C)C)n[nH]2)C1
|
C16H26N4O2 306.410000 |
IJBOJLLGNQPJTF-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281185; PubChem:CID121279534
|
Local ready
Direct docking supported
|
|
E3L012870
BDB012870
|
US10022354, Example 126
CC(C)c1cc(C(=O)N2CCC(NC(=O)/C=C/c3ccccc3)C2)[nH]n1
|
C20H24N4O2 352.438000 |
BSDDJVFXIZRSFP-CMDGGOBGSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281186; PubChem:CID121279535
|
Local ready
Direct docking supported
|
|
E3L012871
BDB012871
|
US10022354, Example 127
COCC(=O)NC1CCN(C(=O)c2cc(C(C)C)n[nH]2)C1
|
C14H22N4O3 294.355000 |
KPKNGSJATOTYAP-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281187; PubChem:CID121279670
|
Local ready
Direct docking supported
|
|
E3L012872
BDB012872
|
US10022354, Example 128
CC(C)c1cc(C(=O)N2CCC(NC(=O)C3(C)CC3)C2)[nH]n1
|
C16H24N4O2 304.394000 |
PVVAPJURUJKQIU-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281188; PubChem:CID121279672
|
Local ready
Direct docking supported
|
|
E3L012873
BDB012873
|
US10022354, Example 129
CCOc1ccccc1C(=O)NC1CCN(C(=O)c2cc(C(C)C)n[nH]2)C1
|
C20H26N4O3 370.453000 |
KADNLRBXQRDTTQ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281189; PubChem:CID121279671
|
Local ready
Direct docking supported
|
|
E3L012874
BDB012874
|
US10022354, Example 130
CC(C)c1cc(C(=O)N2CCC(NC(=O)C3CC3C)C2)[nH]n1
|
C16H24N4O2 304.394000 |
ULLBNYVWXFJISI-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281190; PubChem:CID121279747
|
Local ready
Direct docking supported
|
|
E3L012875
BDB012875
|
US10022354, Example 131
CC1CC(C(=O)NC2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)C1
|
C17H26N4O2 318.421000 |
BFBPTAWZLABJLQ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281191; PubChem:CID121279749
|
Local ready
Direct docking supported
|
|
E3L012876
BDB012876
|
US10022354, Example 132
CC(C)c1cc(C(=O)N2CCC(NC(=O)C3CCOC3)C2)[nH]n1
|
C16H24N4O3 320.393000 |
IKHRJJHJJBKHLU-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281192; PubChem:CID121279755
|
Local ready
Direct docking supported
|
|
E3L012877
BDB012877
|
US10022354, Example 133
CC(C)c1cc(C(=O)N2CCC(NC(=O)C3CC(=O)C3)C2)[nH]n1
|
C16H22N4O3 318.377000 |
SDFYQABGSGXDTR-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281193; PubChem:CID121279750
|
Local ready
Direct docking supported
|
|
E3L012878
BDB012878
|
US10022354, Example 134
CC(C)c1cc(C(=O)N2CCC(NC(=O)C3(C)CCC3)C2)[nH]n1
|
C17H26N4O2 318.421000 |
OFQKLJOCIXURTE-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281194; PubChem:CID121279754
|
Local ready
Direct docking supported
|
|
E3L012879
BDB012879
|
US10022354, Example 135
CC(C)c1cc(C(=O)N2CCC(NC(=O)c3ccc4cc[nH]c4n3)C2)[nH]n1
|
C19H22N6O2 366.425000 |
GFLBXVIXHJBMRD-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281195; PubChem:CID121279751
|
Local ready
Direct docking supported
|
|
E3L012880
BDB012880
|
US10022354, Example 136
CC(C)c1cc(C(=O)N2CCC(NC(=O)c3ccccc3OCc3ccccc3)C2)[nH]n1
|
C25H28N4O3 432.524000 |
GNKWHNDSTHCFPB-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281196; PubChem:CID121279668
|
Local ready
Direct docking supported
|