| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L012341
BDB012341
|
BDBM264010
O=C(O)c1ccnc(-n2nccc2OCc2ccc(Cl)cc2Cl)c1
|
C16H11Cl2N3O3 364.188000 |
JVEGQTZXGNUQNB-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM264010; PubChem:CID90204863
|
Local ready
Direct docking supported
|
|
E3L012342
BDB012342
|
BDBM264012
COc1cc(Cl)ccc1COc1ccnn1-c1cc(C(=O)O)ccn1
|
C17H14ClN3O4 359.769000 |
TVFQMRCHDYLPNH-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM264012; PubChem:CID90204662
|
Local ready
Direct docking supported
|
|
E3L012343
BDB012343
|
BDBM264013
O=C(O)c1ccnc(-n2nccc2OCc2ccc(Cl)c(C(F)(F)F)c2)c1
|
C17H11ClF3N3O3 397.740000 |
XUNRIWDHRHUEJG-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM264013; PubChem:CID90205589
|
Local ready
Direct docking supported
|
|
E3L012344
BDB012344
|
BDBM264014
Cc1ccc(COc2ccnn2-c2cc(C(=O)O)ccn2)cc1Cl
|
C17H14ClN3O3 343.770000 |
BJFOUULYELAMPD-UHFFFAOYSA-N | P29375, Q8NHM5 | Lysine-specific demethylase 5A, Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM264014; PubChem:CID86725570
|
Local ready
Direct docking supported
|
|
E3L012345
BDB012345
|
BDBM264016
Cc1ccc(COc2ccnn2-c2cc(C(=O)O)ccn2)c(F)c1F
|
C17H13F2N3O3 345.305000 |
YVPHKAZMKGNDEA-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM264016; PubChem:CID86725576
|
Local ready
Direct docking supported
|
|
E3L012346
BDB012346
|
BDBM264017
CCc1ccc(COc2ccnn2-c2cc(C(=O)O)ccn2)cc1Cl
|
C18H16ClN3O3 357.797000 |
FJXXVLHXLPRIGW-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM264017; PubChem:CID86725574
|
Local ready
Direct docking supported
|
|
E3L012347
BDB012347
|
BDBM264018
CCc1ccc(COc2ccnn2-c2cc(C(=O)O)ccn2)cc1F
|
C18H16FN3O3 341.342000 |
INIXTIFIUFLZRZ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM264018; PubChem:CID86725578
|
Local ready
Direct docking supported
|
|
E3L012348
BDB012348
|
BDBM264019
N#Cc1cccc(COc2ccnn2-c2cc(C(=O)O)ccn2)c1
|
C17H12N4O3 320.308000 |
RGXVNVRDWNLFAZ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM264019; PubChem:CID86725566
|
Local ready
Direct docking supported
|
|
E3L012349
BDB012349
|
BDBM264020
N#Cc1ccc(COc2ccnn2-c2cc(C(=O)O)ccn2)cc1
|
C17H12N4O3 320.308000 |
WVXRMWSXRNMWLL-UHFFFAOYSA-N | P29375, Q8NHM5 | Lysine-specific demethylase 5A, Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM264020; PubChem:CID86725568
|
Local ready
Direct docking supported
|
|
E3L012350
BDB012350
|
BDBM264021
O=C(O)c1ccnc(-n2nccc2OCc2ccc(Cl)cc2OCc2ccccc2)c1
|
C23H18ClN3O4 435.867000 |
NNMOCDJHJWOBLY-UHFFFAOYSA-N | P29375, Q8NHM5 | Lysine-specific demethylase 2B, Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM264021; PubChem:CID90205426
|
Local ready
Direct docking supported
|
|
E3L012351
BDB012351
|
BDBM264022
O=C(O)c1ccnc(-n2nccc2OCc2ccc(Cl)cc2OCC2CC2)c1
|
C20H18ClN3O4 399.834000 |
CCXBVLGMHSEBLX-UHFFFAOYSA-N | P29375, Q8NHM5 | Lysine-specific demethylase 2B, Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM264022; PubChem:CID90204966
|
Local ready
Direct docking supported
|
|
E3L012352
BDB012352
|
BDBM264023
O=C(O)c1ccnc(-n2nccc2OCc2ccc(Cl)cc2OCC(F)(F)F)c1
|
C18H13ClF3N3O4 427.766000 |
IVOFHPAJLLZMRL-UHFFFAOYSA-N | P29375, Q8NHM5 | Lysine-specific demethylase 5A, Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM264023; PubChem:CID90205315
|
Local ready
Direct docking supported
|
|
E3L012353
BDB012353
|
BDBM264025
CN(C)CCc1cnn(-c2cc(C(=O)O)ccn2)c1OCc1ccc(F)cc1
|
C20H21FN4O3 384.411000 |
ALHWXWTUDYISRS-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM264025; PubChem:CID90205353
|
Local ready
Direct docking supported
|
|
E3L012354
BDB012354
|
BDBM264026
CCCCOc1cc(Cl)ccc1COc1ccnn1-c1cc(C(=O)O)ccn1
|
C20H20ClN3O4 401.850000 |
JQPYWFPJAZZKAV-UHFFFAOYSA-N | P29375, Q8NHM5 | Lysine-specific demethylase 5A, Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM264026; PubChem:CID90205692
|
Local ready
Direct docking supported
|
|
E3L012355
BDB012355
|
BDBM264027
CC(C)COc1cc(Cl)ccc1COc1ccnn1-c1cc(C(=O)O)ccn1
|
C20H20ClN3O4 401.850000 |
UDNZKYWBVTTWJF-UHFFFAOYSA-N | P29375, Q8NHM5 | Lysine-specific demethylase 2B, Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM264027; PubChem:CID90205429
|
Local ready
Direct docking supported
|
|
E3L012356
BDB012356
|
BDBM264028
CC(C)Oc1cc(Cl)ccc1COc1ccnn1-c1cc(C(=O)O)ccn1
|
C19H18ClN3O4 387.823000 |
XEOWFNYWWSWLBN-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM264028; PubChem:CID90205097
|
Local ready
Direct docking supported
|
|
E3L012357
BDB012357
|
BDBM264029
CCC(C)Oc1cc(Cl)ccc1COc1ccnn1-c1cc(C(=O)O)ccn1
|
C20H20ClN3O4 401.850000 |
DRXNXOKZAZEGFK-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM264029; PubChem:CID90205209
|
Local ready
Direct docking supported
|
|
E3L012358
BDB012358
|
BDBM264030
CCOc1cc(Cl)ccc1COc1ccnn1-c1cc(C(=O)O)ccn1
|
C18H16ClN3O4 373.796000 |
GTWJZXSSCNHGGN-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM264030; PubChem:CID90205326
|
Local ready
Direct docking supported
|
|
E3L012359
BDB012359
|
BDBM264031
COCCOc1cc(Cl)ccc1COc1ccnn1-c1cc(C(=O)O)ccn1
|
C19H18ClN3O5 403.822000 |
ZSYSQOMASXIARJ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM264031; PubChem:CID90205092
|
Local ready
Direct docking supported
|
|
E3L012360
BDB012360
|
BDBM264032
O=C(O)c1ccnc(-n2nccc2OCc2ccc(Cl)cc2OCc2ccc(F)cc2)c1
|
C23H17ClFN3O4 453.857000 |
WVEHUIVVPBXOJC-UHFFFAOYSA-N | P29375, Q8NHM5 | Lysine-specific demethylase 5A, Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM264032; PubChem:CID90205497
|
Local ready
Direct docking supported
|