| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L012901
BDB012901
|
US10022354, Example 157
CC(C)c1cc(C(=O)N2CCC(NC(=O)c3ccc(F)cc3)C2)[nH]n1
|
C18H21FN4O2 344.390000 |
AJNMYRPOVQQREJ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281217; PubChem:CID121279666
|
Local ready
Direct docking supported
|
|
E3L012902
BDB012902
|
US10022354, Example 158
COc1ccccc1C(=O)NC1CCN(C(=O)c2cc(C(C)C)n[nH]2)C1
|
C19H24N4O3 356.426000 |
VLSBSEYYXZARPX-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281218; PubChem:CID121279665
|
Local ready
Direct docking supported
|
|
E3L012903
BDB012903
|
US10022354, Example 159
COc1cccc(C(=O)NC2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)c1
|
C19H24N4O3 356.426000 |
PZCXJIXZBWMTAN-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281219; PubChem:CID121279663
|
Local ready
Direct docking supported
|
|
E3L012904
BDB012904
|
US10022354, Example 160
COc1ccc(C(=O)NC2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)cc1
|
C19H24N4O3 356.426000 |
RKLRLFSURNRUDP-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281220; PubChem:CID121279435
|
Local ready
Direct docking supported
|
|
E3L012905
BDB012905
|
US10022354, Example 161
CC(C)c1cc(C(=O)N2CCC(NC(=O)C3CCCO3)C2)[nH]n1
|
C16H24N4O3 320.393000 |
KOGMROSOUZPIGW-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281221; PubChem:CID121279433
|
Local ready
Direct docking supported
|
|
E3L012906
BDB012906
|
US10022354, Example 162
CC(C)c1cc(C(=O)N2CCC(NC(=O)c3ccn(C(C)C)n3)C2)[nH]n1
|
C18H26N6O2 358.446000 |
XWGHHTWXQFJRIW-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281222; PubChem:CID132070202
|
Local ready
Direct docking supported
|
|
E3L012907
BDB012907
|
US10022354, Example 163
CC(C)c1cc(C(=O)N2CCC(NC(=O)C3CC3c3ccccc3)C2)[nH]n1
|
C21H26N4O2 366.465000 |
JMCWXFFNPXGENH-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281223; PubChem:CID132070203
|
Local ready
Direct docking supported
|
|
E3L012908
BDB012908
|
US10022354, Example 164
CC(C)c1cc(C(=O)N2CCC(NC(=O)c3ccccc3Oc3ccccc3)C2)[nH]n1
|
C24H26N4O3 418.497000 |
YYCRFUKVAIETOR-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281224; PubChem:CID132070204
|
Local ready
Direct docking supported
|
|
E3L012909
BDB012909
|
US10022354, Example 165
CCn1ccc(C(=O)NC2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)n1
|
C17H24N6O2 344.419000 |
NGMPSRLNXVCESZ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281225; PubChem:CID121279436
|
Local ready
Direct docking supported
|
|
E3L012910
BDB012910
|
US10022354, Example 166
CC(C)c1cc(C(=O)N2CCC(NC(=O)C3CCCOC3)C2)[nH]n1
|
C17H26N4O3 334.420000 |
CEGZWLXGSIXMHI-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281226; PubChem:CID121279742
|
Local ready
Direct docking supported
|
|
E3L012911
BDB012911
|
US10022354, Example 167
CC(C)c1cc(C(=O)N2CCC(NC(=O)C3CC(N)C3)C2)[nH]n1
|
C16H25N5O2 319.409000 |
QUWFEOAXMSENFV-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281227; PubChem:CID132070205
|
Local ready
Direct docking supported
|
|
E3L012912
BDB012912
|
US10022354, Example 168
CC(C)c1cc(C(=O)N2CCC(NC(=O)C(C)(C)C)C2)[nH]n1
|
C16H26N4O2 306.410000 |
OCBUOMDAMZEBHI-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281228; PubChem:CID132070206
|
Local ready
Direct docking supported
|
|
E3L012913
BDB012913
|
US10022354, Example 169
CC(C)c1cc(C(=O)N2CCC(NC(=O)COc3ccccc3)C2)[nH]n1
|
C19H24N4O3 356.426000 |
KANWYBYXAWSDLV-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281229; PubChem:CID132070209
|
Local ready
Direct docking supported
|
|
E3L012914
BDB012914
|
US10022354, Example 170
CC(O)C(=O)NC1CCN(C(=O)c2cc(C(C)C)n[nH]2)C1
|
C14H22N4O3 294.355000 |
UINMQIJUKDPJNO-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281230; PubChem:CID132070207
|
Local ready
Direct docking supported
|
|
E3L012915
BDB012915
|
US10022354, Example 171
CC(C)c1cc(C(=O)N2CCC(NC(=O)C3(O)CC3)C2)[nH]n1
|
C15H22N4O3 306.366000 |
NVMNMIHRQZBQPG-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281231; PubChem:CID121279614
|
Local ready
Direct docking supported
|
|
E3L012916
BDB012916
|
US10022354, Example 172
CC(C)c1cc(C(=O)N2CCC(NC(=O)C3(C(F)(F)F)CC3)C2)[nH]n1
|
C16H21F3N4O2 358.364000 |
RPJVWKCKJDKIET-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281232; PubChem:CID121279599
|
Local ready
Direct docking supported
|
|
E3L012917
BDB012917
|
US10022354, Example 173
CC(C)c1cc(C(=O)N2CCC(NC(=O)C(C)(C)C(F)(F)F)C2)[nH]n1
|
C16H23F3N4O2 360.380000 |
XQTQOAPOMWPVMP-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281233; PubChem:CID121279619
|
Local ready
Direct docking supported
|
|
E3L012918
BDB012918
|
US10022354, Example 174
COC1(C(=O)NC2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)CC1
|
C16H24N4O3 320.393000 |
QARIATFWGFBKQC-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281234; PubChem:CID132070211
|
Local ready
Direct docking supported
|
|
E3L012919
BDB012919
|
US10022354, Example 175
CC(C)c1cc(C(=O)N2CCC(NC(=O)CC3CC3)C2)[nH]n1
|
C16H24N4O2 304.394000 |
XCEOPXWOKPEPRD-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281235; PubChem:CID132070208
|
Local ready
Direct docking supported
|
|
E3L012920
BDB012920
|
US10022354, Example 176
COCCC(=O)NC1CCN(C(=O)c2cc(C(C)C)n[nH]2)C1
|
C15H24N4O3 308.382000 |
VUNMZOKWNGPBRQ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281236; PubChem:CID132070210
|
Local ready
Direct docking supported
|