| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L012801
BDB012801
|
US10022354, Example 55
Cc1cc(NC(=O)c2ccccc2)cc(C2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)n1
|
C24H27N5O2 417.513000 |
RTRQZSKQIXUIML-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281115; PubChem:CID121279694
|
Local ready
Direct docking supported
|
|
E3L012802
BDB012802
|
US10022354, Example 56
Cc1cc(NS(C)(=O)=O)cc(C2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)n1
|
C18H25N5O3S 391.497000 |
JNNQLGDLDKTARQ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281116; PubChem:CID121279696
|
Local ready
Direct docking supported
|
|
E3L012803
BDB012803
|
US10022354, Example 57
Cc1cc(NS(=O)(=O)c2ccccc2)cc(C2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)n1
|
C23H27N5O3S 453.568000 |
PJUURNQOAWVMOA-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281117; PubChem:CID121279683
|
Local ready
Direct docking supported
|
|
E3L012804
BDB012804
|
US10022354, Example 58
CC(C)c1cc(C(=O)N2CCC(C(=O)NCc3cnn(C)c3)C2)[nH]n1
|
C17H24N6O2 344.419000 |
CQMZJIILHVIKFH-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281118; PubChem:CID132070185
|
Local ready
Direct docking supported
|
|
E3L012805
BDB012805
|
US10022354, Example 59
CC(C)c1cc(C(=O)N2CCC(n3cc(Br)cn3)C2)[nH]n1
|
C14H18BrN5O 352.236000 |
JFPBFPWCRUXYRC-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281119; PubChem:CID121279710
|
Local ready
Direct docking supported
|
|
E3L012806
BDB012806
|
US10022354, Example 60
CC(C)c1cc(C(=O)N2CCC(N3CCCC3=O)C2)[nH]n1
|
C15H22N4O2 290.367000 |
RTXPPAHZEFCKLJ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281120; PubChem:CID121279761
|
Local ready
Direct docking supported
|
|
E3L012807
BDB012807
|
US10022354, Example 61
Cc1cccc(-c2cc(C)nc(C3CCN(C(=O)c4cc(C(C)C)n[nH]4)C3)c2)c1
|
C24H28N4O 388.515000 |
DWKIUDZFZWEOFL-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281121; PubChem:CID121279700
|
Local ready
Direct docking supported
|
|
E3L012808
BDB012808
|
US10022354, Example 62
COc1cccc(-c2cc(C)nc(C3CCN(C(=O)c4cc(C(C)C)n[nH]4)C3)c2)c1
|
C24H28N4O2 404.514000 |
AMWGJZWBMJNXFP-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281122; PubChem:CID121279711
|
Local ready
Direct docking supported
|
|
E3L012809
BDB012809
|
US10022354, Example 63
Cc1cc(-c2ccn[nH]2)cc(C2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)n1
|
C20H24N6O 364.453000 |
KYAHWPYRFJRPDO-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281123; PubChem:CID121279713
|
Local ready
Direct docking supported
|
|
E3L012810
BDB012810
|
US10022354, Example 64
Cc1cc(-c2ccccc2)cc(C2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)n1
|
C23H26N4O 374.488000 |
PSXQAVPYIIBEFD-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281124; PubChem:CID121279715
|
Local ready
Direct docking supported
|
|
E3L012811
BDB012811
|
US10022354, Example 65
Cc1cc(-c2ccncc2)cc(C2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)n1
|
C22H25N5O 375.476000 |
XRTWYACXNJHHBG-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281125; PubChem:CID121279702
|
Local ready
Direct docking supported
|
|
E3L012812
BDB012812
|
US10022354, Example 66
Cc1cc(-c2ccccc2C)cc(C2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)n1
|
C24H28N4O 388.515000 |
GYTIXMGHYWYHPM-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281126; PubChem:CID121279716
|
Local ready
Direct docking supported
|
|
E3L012813
BDB012813
|
US10022354, Example 67
Cc1cc(-c2cccc(C#N)c2)cc(C2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)n1
|
C24H25N5O 399.498000 |
FHHZGVYBDCHFED-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281127; PubChem:CID121279709
|
Local ready
Direct docking supported
|
|
E3L012814
BDB012814
|
US10022354, Example 68
Cc1cc(-c2ccc(C#N)cc2)cc(C2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)n1
|
C24H25N5O 399.498000 |
ISYYMZGUNVIDIJ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281128; PubChem:CID121279727
|
Local ready
Direct docking supported
|
|
E3L012815
BDB012815
|
US10022354, Example 69
Cc1cc(-c2cnn(Cc3ccccc3)c2)cc(C2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)n1
|
C27H30N6O 454.578000 |
ZMMWAYLSGNDHBJ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281129; PubChem:CID121279703
|
Local ready
Direct docking supported
|
|
E3L012816
BDB012816
|
US10022354, Example 70
Cc1cc(-c2ccoc2)cc(C2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)n1
|
C21H24N4O2 364.449000 |
DKUQJFPELDXTEG-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281130; PubChem:CID121279678
|
Local ready
Direct docking supported
|
|
E3L012817
BDB012817
|
US10022354, Example 71
Cc1cc(-c2cccnc2)cc(C2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)n1
|
C22H25N5O 375.476000 |
CKMKMCGQKLICGJ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281131; PubChem:CID121279677
|
Local ready
Direct docking supported
|
|
E3L012818
BDB012818
|
US10022354, Example 72
COc1ccccc1-c1cc(C)nc(C2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)c1
|
C24H28N4O2 404.514000 |
ADOPLAZEYVDBNR-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281132; PubChem:CID121279720
|
Local ready
Direct docking supported
|
|
E3L012819
BDB012819
|
US10022354, Example 73
Cc1cc(C)nc(C2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)c1
|
C18H24N4O 312.417000 |
QYWHLIHVMLNPCM-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281133; PubChem:CID121279714
|
Local ready
Direct docking supported
|
|
E3L012820
BDB012820
|
US10022354, Example 74
Cc1cc(-c2ccsc2)cc(C2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)n1
|
C21H24N4OS 380.517000 |
AMLCZZBEFOGSRO-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM281134; PubChem:CID121279707
|
Local ready
Direct docking supported
|