| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L013841
BDB013841
|
BDBM314112
COc1ccc(CNc2cnccc2C(=O)O)c(OC)c1
|
C15H16N2O4 288.303000 |
CVPSHFLZFGDKFG-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314112; PubChem:CID81753503
|
Local ready
Direct docking supported
|
|
E3L013842
BDB013842
|
3-[(2-Hydroxybenzyl)amino]pyridine-4-carboxylic acid
O=C(O)c1ccncc1NCc1ccccc1O
|
C13H12N2O3 244.250000 |
LAXFVGGKSWNBJU-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314113; PubChem:CID86728204
|
Local ready
Direct docking supported
|
|
E3L013843
BDB013843
|
3-[(2,4-Dichlorobenzyl)amino]pyridine-4-carboxylic acid
O=C(O)c1ccncc1NCc1ccc(Cl)cc1Cl
|
C13H10Cl2N2O2 297.141000 |
DWLFVJYVBIIUOQ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314114; PubChem:CID86728205
|
Local ready
Direct docking supported
|
|
E3L013844
BDB013844
|
BDBM314115
O=C(O)c1ccncc1NCc1ccccc1C1CC1
|
C16H16N2O2 268.316000 |
ULZKCGHMZYARDT-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314115; PubChem:CID77105907
|
Local ready
Direct docking supported
|
|
E3L013845
BDB013845
|
BDBM314116
COc1cc(Cl)ccc1CNc1cnccc1C(=O)O
|
C14H13ClN2O3 292.722000 |
JVYDXIAARLCGCD-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314116; PubChem:CID77105908
|
Local ready
Direct docking supported
|
|
E3L013846
BDB013846
|
BDBM314117
O=C(O)c1ccncc1NCc1ccc(Cl)cc1O
|
C13H11ClN2O3 278.695000 |
SOFSMTPWBPTCCN-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314117; PubChem:CID77105909
|
Local ready
Direct docking supported
|
|
E3L013847
BDB013847
|
3-[(2-Aminobenzyl)amino]pyridine-4-carboxylic acid
Nc1ccccc1CNc1cnccc1C(=O)O
|
C13H13N3O2 243.266000 |
YDQGRVRMPCQIHS-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314118; PubChem:CID77105910
|
Local ready
Direct docking supported
|
|
E3L013848
BDB013848
|
3-[(4-Bromobenzyl)amino]pyridine-4-carboxylic acid
O=C(O)c1ccncc1NCc1ccc(Br)cc1
|
C13H11BrN2O2 307.147000 |
VPMJIWOAYKAZDP-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314119; PubChem:CID77106115
|
Local ready
Direct docking supported
|
|
E3L013849
BDB013849
|
3-[(4-Methylbenzyl)amino]pyridine-4-carboxylic acid
Cc1ccc(CNc2cnccc2C(=O)O)cc1
|
C14H14N2O2 242.278000 |
SZRSAUIAAXWQAM-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314120; PubChem:CID77105911
|
Local ready
Direct docking supported
|
|
E3L013850
BDB013850
|
BDBM314121
O=C(O)c1ccncc1NCc1ccc(C2CC2)cc1
|
C16H16N2O2 268.316000 |
CSMAEIRAHOZMCC-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314121; PubChem:CID77106116
|
Local ready
Direct docking supported
|
|
E3L013851
BDB013851
|
BDBM314122
O=C(O)c1ccncc1NCc1ccc(Cl)cc1C1CC1
|
C16H15ClN2O2 302.761000 |
BKCRIRNVBRGSLK-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314122; PubChem:CID90237082
|
Local ready
Direct docking supported
|
|
E3L013852
BDB013852
|
US9611221, Example 27
O=C(O)c1ccncc1NCc1ccc(C(F)(F)F)cc1C1CC1
|
C17H15F3N2O2 336.313000 |
CAFQJFLUHRINGS-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314123; PubChem:CID77105912
|
Local ready
Direct docking supported
|
|
E3L013853
BDB013853
|
BDBM314124
O=C(O)c1ccncc1NCc1cccc2ccccc12
|
C17H14N2O2 278.311000 |
OZEJSGXSIDJORT-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314124; PubChem:CID77105705
|
Local ready
Direct docking supported
|
|
E3L013854
BDB013854
|
BDBM314125
O=C(O)c1ccncc1NCc1cccc2cc[nH]c12
|
C15H13N3O2 267.288000 |
KVWQFKNSISVJGK-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314125; PubChem:CID77105706
|
Local ready
Direct docking supported
|
|
E3L013855
BDB013855
|
BDBM314126
Cc1cccc(CNc2cnccc2C(=O)O)c1C1CC1
|
C17H18N2O2 282.343000 |
ZAFNBSRBAFJBNP-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314126; PubChem:CID77105913
|
Local ready
Direct docking supported
|
|
E3L013856
BDB013856
|
US9611221, Example 31
O=C(O)c1ccncc1NCc1cnccc1C1CC1
|
C15H15N3O2 269.304000 |
RKMFJZMCCJPHPW-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314127; PubChem:CID77105914
|
Local ready
Direct docking supported
|
|
E3L013857
BDB013857
|
BDBM314128
O=C(O)c1ccncc1NCc1cccc(C(F)(F)F)c1
|
C14H11F3N2O2 296.248000 |
SJCRNIRNMZRLBW-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314128; PubChem:CID77106114
|
Local ready
Direct docking supported
|
|
E3L013858
BDB013858
|
3-[(2-Phenoxybenzyl)amino]pyridine-4-carboxylic acid
O=C(O)c1ccncc1NCc1ccccc1Oc1ccccc1
|
C19H16N2O3 320.348000 |
WCZTUVDGEDXPNK-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314129; PubChem:CID77106118
|
Local ready
Direct docking supported
|
|
E3L013859
BDB013859
|
BDBM314130
Cc1ccc(C2CC2)c(CNc2cnccc2C(=O)O)c1
|
C17H18N2O2 282.343000 |
RTIJIBPFJDZRIG-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314130; PubChem:CID77106120
|
Local ready
Direct docking supported
|
|
E3L013860
BDB013860
|
BDBM314131
O=C(O)c1ccncc1NCc1cccc(OC(F)(F)F)c1
|
C14H11F3N2O3 312.247000 |
DADJCXBYNKOCQO-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM314131; PubChem:CID86728207
|
Local ready
Direct docking supported
|