| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L015421
BDB015421
|
US10202354, Example 88
O=C(c1ccc(Cl)cc1)N1CCN=C1N1CCN(C2CCC2)CC1
|
C18H23ClN4O 346.862000 |
NRVGSEJKKKWPJX-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345423; PubChem:CID121477791
|
Local ready
Direct docking supported
|
|
E3L015422
BDB015422
|
US10202354, Example 89
COc1ccc(C(=O)N2CCN=C2N2CCN(C3CCC3)CC2)cc1
|
C19H26N4O2 342.443000 |
IOEHGJOVFKXLCI-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345424; PubChem:CID121477789
|
Local ready
Direct docking supported
|
|
E3L015423
BDB015423
|
US10202354, Example 90
COc1cccc(C(=O)N2CCN=C2N2CCN(C3CCC3)CC2)c1
|
C19H26N4O2 342.443000 |
DIJHXQXHKWBKHN-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345425; PubChem:CID121477767
|
Local ready
Direct docking supported
|
|
E3L015424
BDB015424
|
US10202354, Example 91
O=C(c1ccccc1O)N1CCN=C1N1CCN(C2CCC2)CC1
|
C18H24N4O2 328.416000 |
ITSPEVXYCLMIDR-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345426; PubChem:CID134194691
|
Local ready
Direct docking supported
|
|
E3L015425
BDB015425
|
US10202354, Example 92
CCCN1CCN(C2=NCCN2S(=O)(=O)c2ccc(C(C)C)cc2)CC1
|
C19H30N4O2S 378.542000 |
FCOCITCFJQMSBM-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345427; PubChem:CID121472725
|
Local ready
Direct docking supported
|
|
E3L015426
BDB015426
|
US10202354, Example 93
CC1CCC(N2CCN(C3=NCCN3S(=O)(=O)c3ccc(C(C)C)cc3)CC2)CC1
|
C23H36N4O2S 432.634000 |
PPAQPYQSNAUUJQ-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345428; PubChem:CID121477868
|
Local ready
Direct docking supported
|
|
E3L015427
BDB015427
|
US10202354, Example 94
CC1CCC(N2CCN(C3=NCCN3S(=O)(=O)c3ccc(C(C)C)cc3)CC2)C1
|
C22H34N4O2S 418.607000 |
PJYKAAOXDFKRFX-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345429; PubChem:CID121477872
|
Local ready
Direct docking supported
|
|
E3L015428
BDB015428
|
US10202354, Example 95
CCC(C)CN1CCN(C2=NCCN2S(=O)(=O)c2ccc(C(C)C)cc2)CC1
|
C21H34N4O2S 406.596000 |
VUZMOTAWVKLVOG-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345430; PubChem:CID121477832
|
Local ready
Direct docking supported
|
|
E3L015429
BDB015429
|
US10202354, Example 96
CCCCC(C)N1CCN(C2=NCCN2S(=O)(=O)c2ccc(C(C)C)cc2)CC1
|
C22H36N4O2S 420.623000 |
LCYPDQAFQFZPLS-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345431; PubChem:CID121477831
|
Local ready
Direct docking supported
|
|
E3L015430
BDB015430
|
US10202354, Example 97
CC(C)c1ccc(S(=O)(=O)N2CCN=C2N2CCN(C3CCC(C)(C)C3)CC2)cc1
|
C23H36N4O2S 432.634000 |
MMHAOXQNDPJTLL-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345432; PubChem:CID121477841
|
Local ready
Direct docking supported
|
|
E3L015431
BDB015431
|
US10202354, Example 98
CCN1CCN(C2=NCCN2S(=O)(=O)c2ccc(-c3ccc(F)cc3)cc2)CC1
|
C21H25FN4O2S 416.522000 |
MYBHQCVWJXIRHI-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345433; PubChem:CID121477833
|
Local ready
Direct docking supported
|
|
E3L015432
BDB015432
|
US10202354, Example 99
CCN1CCN(C2=NCCN2S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1
|
C16H21F3N4O3S 406.430000 |
FXPYQOSCYFQDMV-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345434; PubChem:CID134194680
|
Local ready
Direct docking supported
|
|
E3L015433
BDB015433
|
US10202354, Example 100
CCN1CCN(C2=NCCN2S(=O)(=O)c2ccc(Cl)cc2Cl)CC1
|
C15H20Cl2N4O2S 391.324000 |
IFHSWPJZEQCWFY-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345435; PubChem:CID121477896
|
Local ready
Direct docking supported
|
|
E3L015434
BDB015434
|
US10202354, Example 101
CCN1CCN(C2=NCCN2S(=O)(=O)c2ccc(S(C)(=O)=O)cc2)CC1
|
C16H24N4O4S2 400.526000 |
CYYFFVJPNQCFDY-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345436; PubChem:CID121477840
|
Local ready
Direct docking supported
|
|
E3L015435
BDB015435
|
US10202354, Example 102
CCN1CCN(C2=NCCN2S(=O)(=O)c2ccc(OC(F)(F)F)cc2)CC1
|
C16H21F3N4O3S 406.430000 |
MTPPHCGFIRRZAO-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345437; PubChem:CID121477843
|
Local ready
Direct docking supported
|
|
E3L015436
BDB015436
|
US10202354, Example 103
CCN1CCN(C2=NCCN2S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1
|
C16H21F3N4O2S 390.431000 |
OBGFQUPSJFMCDD-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345438; PubChem:CID121477837
|
Local ready
Direct docking supported
|
|
E3L015437
BDB015437
|
US10202354, Example 104
CCN1CCN(C2=NCCN2S(=O)(=O)c2cccc(OC(F)F)c2)CC1
|
C16H22F2N4O3S 388.440000 |
ZJEZBXNWYVKUAL-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345439; PubChem:CID121477881
|
Local ready
Direct docking supported
|
|
E3L015438
BDB015438
|
US10202354, Example 105
CCN1CCN(C2=NCCN2S(=O)(=O)c2ccc(OC(F)F)cc2)CC1
|
C16H22F2N4O3S 388.440000 |
WOZDIQJYJBPUEB-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345440; PubChem:CID121477834
|
Local ready
Direct docking supported
|
|
E3L015439
BDB015439
|
US10202354, Example 106
CCN1CCN(C2=NCCN2S(=O)(=O)c2cc(Cl)ccc2Cl)CC1
|
C15H20Cl2N4O2S 391.324000 |
IBIKWBOZKGWTKG-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345441; PubChem:CID121477836
|
Local ready
Direct docking supported
|
|
E3L015440
BDB015440
|
US10202354, Example 107
CCN1CCN(C2=NCCN2S(=O)(=O)c2ccc(C(F)(F)F)cc2)CC1
|
C16H21F3N4O2S 390.431000 |
SMTWHIFIEQUUPP-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM345442; PubChem:CID121477838
|
Local ready
Direct docking supported
|