| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L030601
BDB030601
|
US20230271937, Example F2-07
CN(Cc1cccc(OC(F)(F)F)c1)c1ncnc(NC[C@H]2CCN(CC(N)=O)C[C@@H]2O)c1F
|
C21H26F4N6O3 486.470000 |
STVBITGZDWPRME-ZBFHGGJFSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614961; PubChem:CID156496987
|
Local ready
Direct docking supported
|
|
E3L030602
BDB030602
|
US20230271937, Example F2-08
CN(Cc1cccc(C#N)c1)c1ncnc(NC[C@H]2CCN(CC(N)=O)C[C@@H]2O)c1F
|
C21H26FN7O2 427.484000 |
XJBITQJVNPJAJC-SJORKVTESA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM614962; PubChem:CID156497056
|
Local ready
Direct docking supported
|
|
E3L030603
BDB030603
|
BDBM615628
CC(n1cnc(C(=O)N2C[C@@H]3[C@H](C2)[C@H]3C2=NOC(C)(C)C2)c1)C(F)(F)F
|
C17H21F3N4O2 370.375000 |
TUZBNSGQDAGILF-SBHLVVLUSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM615628
|
Local ready
Direct docking supported
|
|
E3L030604
BDB030604
|
BDBM615630
C[C@@H](c1ccccc1C#N)n1cnc(C(=O)N2C[C@@H]3[C@H](C2)[C@H]3C2=NOC(C)(C)C2)c1
|
C23H25N5O2 403.486000 |
ZWKRPZNMZJSQNE-MUMXORNYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM615630
|
Local ready
Direct docking supported
|
|
E3L030605
BDB030605
|
BDBM615631
C[C@@H](c1ccc(C#N)cc1)n1cnc(C(=O)N2C[C@@H]3[C@H](C2)[C@H]3C2=NOC(C)(C)C2)c1
|
C23H25N5O2 403.486000 |
UOFGVWKZSHBPSS-MUMXORNYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM615631
|
Local ready
Direct docking supported
|
|
E3L030606
BDB030606
|
BDBM615632
C[C@@H](c1nccs1)n1cnc(C(=O)N2C[C@@H]3[C@H](C2)[C@H]3C2=NOC(C)(C)C2)c1
|
C19H23N5O2S 385.493000 |
ZZGPMRWAHXMYPY-BCUIYNNISA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM615632
|
Local ready
Direct docking supported
|
|
E3L030607
BDB030607
|
BDBM615634
CC(C)n1cnc(C(=O)N2C[C@@H]3[C@H](C2)[C@H]3C2=NOC(C)(C(F)F)C2)c1
|
C17H22F2N4O2 352.385000 |
MHYJPOVWHJXQEI-JLRAQOTISA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM615634
|
Local ready
Direct docking supported
|
|
E3L030608
BDB030608
|
BDBM615636
Cc1onc([C@H]2[C@@H]3CN(C(=O)c4cn(C(C)C)cn4)C[C@@H]32)c1-c1ccccc1
|
C22H24N4O2 376.460000 |
AROZBFWMXNVTLN-YRWFTTLQSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM615636
|
Local ready
Direct docking supported
|
|
E3L030609
BDB030609
|
BDBM615637
Cc1cc([C@H]2[C@@H]3CN(C(=O)c4cn(C(C)C)cn4)C[C@@H]32)no1
|
C16H20N4O2 300.362000 |
BQTJLFOVNLUPFY-JYAVWHMHSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM615637
|
Local ready
Direct docking supported
|
|
E3L030610
BDB030610
|
BDBM615638
CC(C)n1cnc(C(=O)N2C[C@@H]3[C@H](C2)[C@H]3C2=NOC(C)(C)N2C)c1
|
C17H25N5O2 331.420000 |
KPTGVIIQAARMAH-IMRBUKKESA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM615638
|
Local ready
Direct docking supported
|
|
E3L030611
BDB030611
|
BDBM615639
CCN1C([C@H]2[C@@H]3CN(C(=O)c4cn(C(C)C)cn4)C[C@@H]32)=NOC1(C)C
|
C18H27N5O2 345.447000 |
ZUUAPHURZXOPCR-NHAGDIPZSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM615639
|
Local ready
Direct docking supported
|
|
E3L030612
BDB030612
|
BDBM615640
CC(C)n1cnc(C(=O)N2C[C@@H]3[C@H](C2)[C@H]3c2nnn3ccccc23)c1
|
C18H20N6O 336.399000 |
RIQDTFFFDKPBAU-VIKVFOODSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM615640
|
Local ready
Direct docking supported
|
|
E3L030613
BDB030613
|
BDBM615641
CC(C)n1cnc(C(=O)N2C[C@@H]3[C@H](C2)[C@H]3c2nnn[nH]2)c1
|
C13H17N7O 287.327000 |
OKUPWWPBALOJLU-JZYVYDRUSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM615641
|
Local ready
Direct docking supported
|
|
E3L030614
BDB030614
|
BDBM615642
CC(C)n1cnc(C(=O)N2C[C@@H]3[C@H](C2)[C@H]3C(=O)NC(C)(C)C)c1
|
C17H26N4O2 318.421000 |
RQJBMICURYTJKH-IMRBUKKESA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM615642
|
Local ready
Direct docking supported
|
|
E3L030615
BDB030615
|
BDBM615643
CC(C)n1cnc(C(=O)N2C[C@@H]3[C@H](C2)[C@H]3C(=O)N(C)C(C)(C)C)c1
|
C18H28N4O2 332.448000 |
TWUJMWMDAWIMJX-NHAGDIPZSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM615643
|
Local ready
Direct docking supported
|
|
E3L030616
BDB030616
|
BDBM615644
CC(C)n1cnc(C(=O)N2C[C@@H]3[C@H](C2)[C@H]3C(=O)N(C)C2(C#N)CC2)c1
|
C18H23N5O2 341.415000 |
MMCRJAJVHRPWET-NHAGDIPZSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM615644
|
Local ready
Direct docking supported
|
|
E3L030617
BDB030617
|
BDBM615645
CC(C)n1cnc(C(=O)N2C[C@@H]3[C@H](C2)[C@H]3C(=O)C2CC2)c1
|
C16H21N3O2 287.363000 |
YJQZYYAHVBHGEK-IMRBUKKESA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM615645
|
Local ready
Direct docking supported
|
|
E3L030618
BDB030618
|
BDBM615646
CC(C)n1cnc(C(=O)N2C[C@@H]3[C@H](C2)[C@H]3C(=O)c2cccs2)c1
|
C17H19N3O2S 329.425000 |
MNSOWDMDYJFSLD-JYAVWHMHSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM615646
|
Local ready
Direct docking supported
|
|
E3L030619
BDB030619
|
BDBM615647
Cc1csc(C(=O)[C@H]2[C@@H]3CN(C(=O)c4cn(C(C)C)cn4)C[C@@H]32)c1
|
C18H21N3O2S 343.452000 |
DLTHNYYLLLWXSS-VIKVFOODSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM615647
|
Local ready
Direct docking supported
|
|
E3L030620
BDB030620
|
BDBM615650
CC(C)n1cnc(C(=O)N2C[C@@H]3[C@H](C2)[C@@]3(C)C2=NOC3(CC3)C2)c1
|
C18H24N4O2 328.416000 |
VRLZGEARFQFGTC-LAQFHYBYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB
BindingDB:BDBM615650
|
Local ready
Direct docking supported
|