| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L036761
BDB036761
|
US12269819, Example B2
CN(CCN(C)c1ccc(O)cc1)C(=O)[C@@H]1O[C@H](CO)[C@H](O)[C@H](n2cc(-c3cccc(F)c3)nn2)[C@H]1O
|
C25H30FN5O6 515.542000 |
XQSYUPJOCAPBKD-OYTPZHDJSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731635; PubChem:CID155201801
|
Local ready
Direct docking supported
|
|
E3L036762
BDB036762
|
US12269819, Example B4
CN(CCNc1ccc(O)cc1)C(=O)[C@@H]1O[C@H](CO)[C@H](O)[C@H](n2cc(-c3cccc(F)c3)nn2)[C@H]1O
|
C24H28FN5O6 501.515000 |
SYQGGRPOLXDSCC-BMXMUORJSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731636; PubChem:CID155201810
|
Local ready
Direct docking supported
|
|
E3L036763
BDB036763
|
US12269819, Example B5
CN(CCNc1ccc(OCc2ccccc2)cc1)C(=O)[C@@H]1O[C@H](CO)[C@H](O)[C@H](n2cc(-c3cccc(F)c3)nn2)[C@H]1O
|
C31H34FN5O6 591.640000 |
BHLLKGQPVFBVOB-HBMYTODVSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731637; PubChem:CID155201804
|
Local ready
Direct docking supported
|
|
E3L036764
BDB036764
|
US12269819, Example B6
COc1ccc(NCCNC(=O)[C@@H]2O[C@H](CO)[C@H](O)[C@H](n3cc(-c4cccc(F)c4)nn3)[C@H]2O)cc1
|
C24H28FN5O6 501.515000 |
NJSUBMHCDVTUMY-BMXMUORJSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731638; PubChem:CID155201811
|
Local ready
Direct docking supported
|
|
E3L036765
BDB036765
|
US12269819, Example B7
COc1ccc(NCCN(C)C(=O)[C@@H]2O[C@H](CO)[C@H](O)[C@H](n3cc(-c4cccc(F)c4)nn3)[C@H]2O)cc1
|
C25H30FN5O6 515.542000 |
FFOAQHLPWTUDGE-OYTPZHDJSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731639; PubChem:CID155201805
|
Local ready
Direct docking supported
|
|
E3L036766
BDB036766
|
US12269819, Example B8
COc1ccc(N(C)CCN(C)C(=O)[C@@H]2O[C@H](CO)[C@H](O)[C@H](n3cc(-c4cccc(F)c4)nn3)[C@H]2O)cc1
|
C26H32FN5O6 529.569000 |
JCWKKVGMRQNNHN-ZLOLNMDISA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731640; PubChem:CID155201814
|
Local ready
Direct docking supported
|
|
E3L036767
BDB036767
|
US12269819, Example B8
COc1ccc(N(C)CCN(C)C(=O)[C@@H]2O[C@H](CO)[C@H](O)[C@H](n3cc(-c4cccc(F)c4)nn3)[C@H]2O)cc1
|
C26H32FN5O6 529.569000 |
JCWKKVGMRQNNHN-ZLOLNMDISA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731641; PubChem:CID155201814
|
Local ready
Direct docking supported
|
|
E3L036768
BDB036768
|
US12269819, Example B10
COc1ccccc1NCCNC(=O)[C@@H]1O[C@H](CO)[C@H](O)[C@H](n2cc(-c3cccc(F)c3)nn2)[C@H]1O
|
C24H28FN5O6 501.515000 |
KLXMSTAUDZATPM-BMXMUORJSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731642; PubChem:CID155201802
|
Local ready
Direct docking supported
|
|
E3L036769
BDB036769
|
US12269819, Example B11
CN(CCNC(=O)[C@@H]1O[C@H](CO)[C@H](O)[C@H](n2cc(-c3cccc(F)c3)nn2)[C@H]1O)c1ccc2c(c1)OCO2
|
C25H28FN5O7 529.525000 |
MPSWZPNSDVLWLS-OYTPZHDJSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731643; PubChem:CID155201812
|
Local ready
Direct docking supported
|
|
E3L036770
BDB036770
|
US12269819, Example B12
CN(CCN(C)c1ccc2c(c1)OCO2)C(=O)[C@@H]1O[C@H](CO)[C@H](O)[C@H](n2cc(-c3cccc(F)c3)nn2)[C@H]1O
|
C26H30FN5O7 543.552000 |
VMUPVZFSYWSELR-ZLOLNMDISA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731645; PubChem:CID155201807
|
Local ready
Direct docking supported
|
|
E3L036771
BDB036771
|
US12269819, Example B13
COc1ccccc1N(C)CCN(C)C(=O)[C@@H]1O[C@H](CO)[C@H](O)[C@H](n2cc(-c3cccc(F)c3)nn2)[C@H]1O
|
C26H32FN5O6 529.569000 |
VMGNSDKSELAXIG-ZLOLNMDISA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731646; PubChem:CID155201813
|
Local ready
Direct docking supported
|
|
E3L036772
BDB036772
|
US12269819, Example B14
COc1ccc(N(C)CCN(C)C(=O)[C@@H]2O[C@H](CO)[C@H](O)[C@H](n3cc(-c4cccc(F)c4)nn3)[C@H]2OC)cc1
|
C27H34FN5O6 543.596000 |
WNMNPERUKRESOJ-RSFKBIFASA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731648; PubChem:CID164767568
|
Local ready
Direct docking supported
|
|
E3L036773
BDB036773
|
US12269819, Example B15
COc1ccc(N(C)CCNC(=O)[C@@H]2O[C@H](CO)[C@H](O)[C@H](n3cc(-c4cccc(F)c4)nn3)[C@H]2OC)cc1
|
C26H32FN5O6 529.569000 |
HEBRCEBJEHHVNX-ZLOLNMDISA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731649; PubChem:CID167063201
|
Local ready
Direct docking supported
|
|
E3L036774
BDB036774
|
US12269819, Example B16
COc1ccc(NCCNC(=O)[C@@H]2O[C@H](CO)[C@H](O)[C@H](n3cc(-c4cccc(F)c4)nn3)[C@H]2OC)cc1
|
C25H30FN5O6 515.542000 |
BLTHQWFINROJJN-OYTPZHDJSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731650; PubChem:CID167063360
|
Local ready
Direct docking supported
|
|
E3L036775
BDB036775
|
US12269819, Example B17
COc1ccc(NCCNC(=O)[C@@H]2O[C@H](CO)[C@H](O)[C@H](n3cc(-c4cccc(F)c4)nn3)[C@H]2OC)cn1
|
C24H29FN6O6 516.530000 |
CPJMAXQDKNMYTC-YDXQKAQTSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731651; PubChem:CID155201752
|
Local ready
Direct docking supported
|
|
E3L036776
BDB036776
|
US12269819, Example B18
CO[C@@H]1[C@@H](n2cc(-c3cccc(F)c3)nn2)[C@@H](O)[C@@H](CO)O[C@H]1C(=O)N(C)CCN(C)c1ccc2c(cnn2C)c1
|
C28H34FN7O5 567.622000 |
XQPDZRNRZVBSGK-LXSUACKSSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731652; PubChem:CID155201746
|
Local ready
Direct docking supported
|
|
E3L036777
BDB036777
|
US12269819, Example B20
COc1ccc(NCCN(C)C(=O)C[C@@H]2O[C@H](CO)[C@H](O)[C@H](n3cc(-c4cccc(F)c4)nn3)[C@H]2O)cc1
|
C26H32FN5O6 529.569000 |
DWHKXMFHTDXKAL-AUOTXKHZSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731653; PubChem:CID155201795
|
Local ready
Direct docking supported
|
|
E3L036778
BDB036778
|
US12269819, Example B21
COc1ccc(N(C)CCN(C)C(=O)C[C@@H]2O[C@H](CO)[C@H](O)[C@H](n3cc(-c4cccc(F)c4)nn3)[C@H]2O)cc1
|
C27H34FN5O6 543.596000 |
IYLMPIYIYBGTKK-SZIGWMETSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731654; PubChem:CID155201794
|
Local ready
Direct docking supported
|
|
E3L036779
BDB036779
|
US12269819, Example B21
COc1ccc(N(C)CCN(C)C(=O)C[C@@H]2O[C@H](CO)[C@H](O)[C@H](n3cc(-c4cccc(F)c4)nn3)[C@H]2O)cc1
|
C27H34FN5O6 543.596000 |
IYLMPIYIYBGTKK-SZIGWMETSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731655; PubChem:CID155201794
|
Local ready
Direct docking supported
|
|
E3L036780
BDB036780
|
US12269819, Example B20
COc1ccc(NCCN(C)C(=O)C[C@@H]2O[C@H](CO)[C@H](O)[C@H](n3cc(-c4cccc(F)c4)nn3)[C@H]2O)cc1
|
C26H32FN5O6 529.569000 |
DWHKXMFHTDXKAL-AUOTXKHZSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM731656; PubChem:CID155201795
|
Local ready
Direct docking supported
|