| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L049961
BDB049961
|
US10022354, Example 152
CC(C)c1cc(C(=O)N2CCC(NC(=O)C3CCC3)C2)n[nH]1
|
C16H24N4O2 304.394000 |
WFZQSICPYNAMNU-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50253041; PubChem:CID121279737
|
Local ready
Direct docking supported
|
|
E3L049962
BDB049962
|
US10022354, Example 151
CC(C)c1cc(C(=O)N2CCC(NC(=O)C3CC3)C2)n[nH]1
|
C15H22N4O2 290.367000 |
CXEXTVGTDZRKJS-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50253042; PubChem:CID132054530
|
Local ready
Direct docking supported
|
|
E3L049963
BDB049963
|
BDBM50253043
CC(C)c1cc(C(=O)N2CCC(NC(=O)c3ccccc3)C2)[nH]n1
|
C18H22N4O2 326.400000 |
RNQBSNIBYKAZGI-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50253043; PubChem:CID137638363
|
Local ready
Direct docking supported
|
|
E3L049964
BDB049964
|
BDBM50253044
Cc1cc(-c2cnn(C)c2)cc(C2CCN(Cc3cc(C(C)C)n[nH]3)C2)n1
|
C21H28N6 364.497000 |
UUDIYABFMNMWRN-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50253044; PubChem:CID137659279
|
Local ready
Direct docking supported
|
|
E3L049965
BDB049965
|
BDBM50253045
Cc1cc(-c2cnn(C)c2)cc(C2CCN(S(=O)(=O)c3cc(C(C)C)n[nH]3)C2)n1
|
C20H26N6O2S 414.535000 |
RHVGGGVCGMQTKZ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50253045; PubChem:CID137639466
|
Local ready
Direct docking supported
|
|
E3L049966
BDB049966
|
BDBM50253046
Cc1cc(-c2cnn(C)c2)cc(C2CCCN(C(=O)c3cc(C(C)C)n[nH]3)C2)n1
|
C22H28N6O 392.507000 |
YINCFBMMUIYUAX-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50253046; PubChem:CID137645322
|
Local ready
Direct docking supported
|
|
E3L049967
BDB049967
|
BDBM50253047
Cc1cc(-c2cnn(C)c2)cc(C2CCN(C(=O)c3cc(C(C)C)no3)C2)n1
|
C21H25N5O2 379.464000 |
AIMGRWXXXWVBGW-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50253047; PubChem:CID137653564
|
Local ready
Direct docking supported
|
|
E3L049968
BDB049968
|
BDBM50253048
Cc1cc(-c2cnn(C)c2)cc(C2CCN(C(=O)c3cc(C(C)C)on3)C2)n1
|
C21H25N5O2 379.464000 |
OXGWILRGHJNPMJ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50253048; PubChem:CID137632294
|
Local ready
Direct docking supported
|
|
E3L049969
BDB049969
|
BDBM50253049
Cc1cc(-c2cnn(C)c2)cc(C2CCN(C(=O)c3cc(C(C)C)n(C)n3)C2)n1
|
C22H28N6O 392.507000 |
FMVJJSPKBXQSEI-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50253049; PubChem:CID137654812
|
Local ready
Direct docking supported
|
|
E3L049970
BDB049970
|
BDBM50253050
Cc1cc(-c2cnn(C)c2)cc(C2CCN(C(=O)c3cc(C(C)C)nn3C)C2)n1
|
C22H28N6O 392.507000 |
CLOYPEOSPLNILY-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50253050; PubChem:CID137636770
|
Local ready
Direct docking supported
|
|
E3L049971
BDB049971
|
BDBM50253058
Cc1cc(C(=O)N2CCC(c3cc(-c4cnn(C)c4)cc(C)n3)C2)[nH]n1
|
C19H22N6O 350.426000 |
VSXQHGDYMVKVRR-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50253058; PubChem:CID121279698
|
Local ready
Direct docking supported
|
|
E3L049972
BDB049972
|
BDBM50253059
CC(=O)c1cc(C(=O)N2CCC(c3cc(-c4cnn(C)c4)cc(C)n3)C2)[nH]n1
|
C20H22N6O2 378.436000 |
DXTOTRNBQCJEMI-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50253059; PubChem:CID137646808
|
Local ready
Direct docking supported
|
|
E3L049973
BDB049973
|
BDBM50253060
Cc1cc(-c2cnn(C)c2)cc(C2CCN(C(=O)c3cc(C(C)C)n[nH]3)C2)c1
|
C22H27N5O 377.492000 |
LJHOOLBPFCTVGI-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50253060; PubChem:CID132070189
|
Local ready
Direct docking supported
|
|
E3L049974
BDB049974
|
BDBM50253061
CC(C)c1cc(C(=O)N2CCC(N3CCOCC3)C2)[nH]n1
|
C15H24N4O2 292.383000 |
HSHLWZKCMSCSMW-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50253061; PubChem:CID137647924
|
Local ready
Direct docking supported
|
|
E3L049975
BDB049975
|
US10022354, Example 168
CC(C)c1cc(C(=O)N2CCC(NC(=O)C(C)(C)C)C2)n[nH]1
|
C16H26N4O2 306.410000 |
OCBUOMDAMZEBHI-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50253064; PubChem:CID132070206
|
Local ready
Direct docking supported
|
|
E3L049976
BDB049976
|
BDBM50253065
Cc1cc(-c2cnn(C)c2)cc(C2CCN(C(=O)c3cc(C(C)C)n[nH]3)CC2)n1
|
C22H28N6O 392.507000 |
JXNUICKRECBFNP-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50253065; PubChem:CID137635888
|
Local ready
Direct docking supported
|
|
E3L049977
BDB049977
|
BDBM50253066
Cc1cc(-c2cnn(C)c2)cc(C2CCN(C(=O)c3cnc(C(C)C)s3)C2)n1
|
C21H25N5OS 395.532000 |
XAGDCRJELBWUMZ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50253066; PubChem:CID137633084
|
Local ready
Direct docking supported
|
|
E3L049978
BDB049978
|
BDBM50253067
Cc1cc(-c2cnn(C)c2)cc(C2CCN(C(=O)c3cc(N(C)C)n[nH]3)C2)n1
|
C20H25N7O 379.468000 |
PLNMMISHXAKOKM-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50253067; PubChem:CID137661457
|
Local ready
Direct docking supported
|
|
E3L049979
BDB049979
|
Ksg-yeklssiesdv
CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)O)C(C)C
|
C66H108N16O26 1541.676000 |
OYOJPGJCPOXGEB-QBAAMSOUSA-N | P78352 | Disks large homolog 4 |
BindingDB, PubChem
BindingDB:BDBM50253143; PubChem:CID44568937
|
Local ready
Direct docking supported
|
|
E3L049980
BDB049980
|
Ksg-ldtknykqtsv
CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O
|
C67H113N19O24 1568.750000 |
LZIFLRQJFWVNPC-NBGMAUTBSA-N | P78352 | Disks large homolog 4 |
BindingDB, PubChem
BindingDB:BDBM50253144; PubChem:CID44568938
|
Local ready
Direct docking supported
|