| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L012641
BDB012641
|
US10071984, Example 43
FC(F)(F)Cn1cnc(-c2cc3[nH]nnc3cn2)c1
|
C10H7F3N6 268.202000 |
JSGDESHALYEAHD-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM276081; PubChem:CID118956728
|
Local ready
Direct docking supported
|
|
E3L012642
BDB012642
|
US10071984, Example 44
c1ccc(Cn2cnc(-c3cc4[nH]nnc4cn3)c2)cc1
|
C15H12N6 276.303000 |
HXVYFHLWSBBJSM-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM276082; PubChem:CID118956702
|
Local ready
Direct docking supported
|
|
E3L012643
BDB012643
|
US10071984, Example 45
Clc1ccccc1Cn1cnc(-c2cc3[nH]nnc3cn2)c1
|
C15H11ClN6 310.748000 |
NZRMHFYQBPOOHK-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM276083; PubChem:CID118956741
|
Local ready
Direct docking supported
|
|
E3L012644
BDB012644
|
US10071984, Example 46
Clc1cccc(Cn2cnc(-c3cc4[nH]nnc4cn3)c2)c1
|
C15H11ClN6 310.748000 |
WLHOJGUAXPKUMX-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM276084; PubChem:CID118956732
|
Local ready
Direct docking supported
|
|
E3L012645
BDB012645
|
US10071984, Example 47
Clc1ccc(Cn2cnc(-c3cc4[nH]nnc4cn3)c2)cc1
|
C15H11ClN6 310.748000 |
NBFQZZXPJYKQDP-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM276085; PubChem:CID118956734
|
Local ready
Direct docking supported
|
|
E3L012646
BDB012646
|
US10071984, Example 48
Clc1ccc(Cn2cnc(-c3cc4[nH]nnc4cn3)c2)cc1Cl
|
C15H10Cl2N6 345.193000 |
JHUVNOIUTLYUSM-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM276086; PubChem:CID118956754
|
Local ready
Direct docking supported
|
|
E3L012647
BDB012647
|
US10071984, Example 49
Clc1ccc(-n2cnc(-c3cc4[nH]nnc4cn3)c2)cc1
|
C14H9ClN6 296.721000 |
RTNFARMIXLCQMZ-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM276087; PubChem:CID118956762
|
Local ready
Direct docking supported
|
|
E3L012648
BDB012648
|
US10071984, Example 50
Clc1ccccc1-n1cnc(-c2cc3[nH]nnc3cn2)c1
|
C14H9ClN6 296.721000 |
QWLHZASLSJLTMK-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM276088; PubChem:CID118956701
|
Local ready
Direct docking supported
|
|
E3L012649
BDB012649
|
US10071984, Example 51
Clc1cccc(-n2cnc(-c3cc4[nH]nnc4cn3)c2)c1
|
C14H9ClN6 296.721000 |
JBJDLWPSFZCGLI-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM276089; PubChem:CID118956774
|
Local ready
Direct docking supported
|
|
E3L012650
BDB012650
|
US10071984, Example 52
Clc1cc(Cl)cc(-n2cnc(-c3cc4[nH]nnc4cn3)c2)c1
|
C14H8Cl2N6 331.166000 |
PXBUOEOSFSTIDA-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM276090; PubChem:CID118956765
|
Local ready
Direct docking supported
|
|
E3L012651
BDB012651
|
BDBM276091
Cn1cnc(-c2cc3[nH]nnc3cn2)c1-c1ccc(F)cc1
|
C15H11FN6 294.293000 |
DFIZSWCEVFIDEP-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM276091; PubChem:CID118956750
|
Local ready
Direct docking supported
|
|
E3L012652
BDB012652
|
US10071984, Example 54
Cn1cnc(-c2cc3[nH]nnc3cn2)c1-c1ccc(F)cc1OCC1CC1
|
C19H17FN6O 364.384000 |
IJEOCHNJDZZTLK-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM276092; PubChem:CID118956677
|
Local ready
Direct docking supported
|
|
E3L012653
BDB012653
|
BDBM276093
Clc1ccccc1Cn1cnc(-c2cc(-c3cn[nH]n3)ccn2)c1Br
|
C17H12BrClN6 415.682000 |
FBNBVIIMXLLIEO-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM276093; PubChem:CID118956767
|
Local ready
Direct docking supported
|
|
E3L012654
BDB012654
|
US10040779, Example 1
Cn1nc(Nc2cnccc2C(=O)O)c2ccccc21
|
C14H12N4O2 268.276000 |
CPZUCKVTDNNRCJ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM277704; PubChem:CID76282043
|
Local ready
Direct docking supported
|
|
E3L012655
BDB012655
|
US10040779, Example 2
Cn1nc2ccccc2c1Nc1cnccc1C(=O)O
|
C14H12N4O2 268.276000 |
XHLDZZFRSRZGNZ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM277705; PubChem:CID90216494
|
Local ready
Direct docking supported
|
|
E3L012656
BDB012656
|
3-(1,2-Benzoxazol-3-ylamino]pyridine-4-carboxylic acid
O=C(O)c1ccncc1Nc1noc2ccccc12
|
C13H9N3O3 255.233000 |
BISRMYZLPKDLOS-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM277706; PubChem:CID76282045
|
Local ready
Direct docking supported
|
|
E3L012657
BDB012657
|
US10040779, Example 4
Cn1nc(Nc2cnccc2C(=O)O)c2cc(Cl)ccc21
|
C14H11ClN4O2 302.721000 |
TXMBUJQSVXBAFZ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM277707; PubChem:CID75202257
|
Local ready
Direct docking supported
|
|
E3L012658
BDB012658
|
US10040779, Example 5
Cc1ccc2c(Nc3cnccc3C(=O)O)nn(C)c2c1
|
C15H14N4O2 282.303000 |
OXJMVTIHWYNOFO-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM277708; PubChem:CID76282047
|
Local ready
Direct docking supported
|
|
E3L012659
BDB012659
|
US10040779, Example 6
Cn1nc(Nc2cnccc2C(=O)O)c2ccc(F)cc21
|
C14H11FN4O2 286.266000 |
LVURFDXVKLZEMI-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM277709; PubChem:CID90216458
|
Local ready
Direct docking supported
|
|
E3L012660
BDB012660
|
BDBM277710
Cn1nc(Nc2cnccc2C(=O)O)c2cc(F)ccc21
|
C14H11FN4O2 286.266000 |
SXBMYQHPOVFVHF-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM277710; PubChem:CID76282049
|
Local ready
Direct docking supported
|