| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L017141
BDB017141
|
US10280149, Example 51
COc1ccc2cc(C(=O)C3CCCN(C4CCCC4)C3)ccc2c1C
|
C23H29NO2 351.490000 |
XKROKWCGWISJBM-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383542; PubChem:CID121479116
|
Local ready
Direct docking supported
|
|
E3L017142
BDB017142
|
US10280149, Example 52
COc1ccc2cc(C(=O)C3CCCN(C4CCC4)C3)ccc2c1C
|
C22H27NO2 337.463000 |
GDACHNLSANYCQR-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383543; PubChem:CID121479115
|
Local ready
Direct docking supported
|
|
E3L017143
BDB017143
|
US10280149, Example 53
COc1ccc2cc(C(=O)C3CCCN(CC4CC4)C3)ccc2c1CC#N
|
C23H26N2O2 362.473000 |
SSSZOXBPBNLSFS-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383544; PubChem:CID121479119
|
Local ready
Direct docking supported
|
|
E3L017144
BDB017144
|
US10280149, Example 54
COc1ccc2cc(C(=O)C3CCCN(C4CCCC4)C3)ccc2c1CC#N
|
C24H28N2O2 376.500000 |
UPTGCJUFHJXXNN-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383545; PubChem:CID121479120
|
Local ready
Direct docking supported
|
|
E3L017145
BDB017145
|
US10280149, Example 55
COc1ccc2cc(C(=O)C3CCCN(C4CCC4)C3)ccc2c1CC#N
|
C23H26N2O2 362.473000 |
FYBQNEKPUGASSS-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383546; PubChem:CID121473863
|
Local ready
Direct docking supported
|
|
E3L017146
BDB017146
|
US10280149, Example 56
CCCN1CCCC(C(=O)c2ccc3c(CC#N)c(OC)ccc3c2)C1
|
C22H26N2O2 350.462000 |
BHUXKOFFUWFILX-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383547; PubChem:CID121473932
|
Local ready
Direct docking supported
|
|
E3L017147
BDB017147
|
BDBM383548
O=C(c1cc(CO)c2ccccc2c1)C1CCCN(C2CCCC2)C1
|
C22H27NO2 337.463000 |
DWERYZKKAKQYNY-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383548; PubChem:CID121479330
|
Local ready
Direct docking supported
|
|
E3L017148
BDB017148
|
BDBM383549
O=C(c1cc(CO)c2ccccc2c1)C1CCCN(C2CCC2)C1
|
C21H25NO2 323.436000 |
HRJYSOFQCQEOIX-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383549; PubChem:CID121479331
|
Local ready
Direct docking supported
|
|
E3L017149
BDB017149
|
US10280149, Example 59
Cc1cccc2ccc(C(=O)C3CCCN(CC4CC4)C3)cc12
|
C21H25NO 307.437000 |
SZNSABWJKZCHIY-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383550; PubChem:CID121479292
|
Local ready
Direct docking supported
|
|
E3L017150
BDB017150
|
(8-Methyl-2-naphthyl)-(1-propyl-3-piperidyl)methanone
CCCN1CCCC(C(=O)c2ccc3cccc(C)c3c2)C1
|
C20H25NO 295.426000 |
REOWISCMQWQNDA-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383551; PubChem:CID121479289
|
Local ready
Direct docking supported
|
|
E3L017151
BDB017151
|
BDBM383552
Cc1cccc2ccc(C(=O)C3CCCN(C4CCCC4)C3)cc12
|
C22H27NO 321.464000 |
VRALDKJNSCBHDS-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383552; PubChem:CID121479293
|
Local ready
Direct docking supported
|
|
E3L017152
BDB017152
|
BDBM383553
Cc1cccc2ccc(C(=O)C3CCCN(C4CCC4)C3)cc12
|
C21H25NO 307.437000 |
IDLRUQASVGQTHR-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383553; PubChem:CID121479290
|
Local ready
Direct docking supported
|
|
E3L017153
BDB017153
|
US10280149, Example 63
CC(O)c1cc(C(=O)C2CCCN(C3CCCC3)C2)cc2ccccc12
|
C23H29NO2 351.490000 |
LNHKBDHVIVGUKO-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383554; PubChem:CID121479288
|
Local ready
Direct docking supported
|
|
E3L017154
BDB017154
|
US10280149, Example 64
CC(O)c1cc(C(=O)C2CCCN(C3CCC3)C2)cc2ccccc12
|
C22H27NO2 337.463000 |
XGVDRJHXDLBNLU-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383555; PubChem:CID121479291
|
Local ready
Direct docking supported
|
|
E3L017155
BDB017155
|
BDBM383556
COc1ccc2cc(C(=O)C3CCCN(C4CC(C#N)C4)C3)ccc2c1
|
C22H24N2O2 348.446000 |
ULAGITALVLRTEO-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383556; PubChem:CID121479029
|
Local ready
Direct docking supported
|
|
E3L017156
BDB017156
|
US10280149, Example 66
COc1ccc2cc(C(=O)C3CCCN(C4CC(F)(F)C4)C3)ccc2c1
|
C21H23F2NO2 359.416000 |
JRYMSOZKLGEFQC-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383557; PubChem:CID121478991
|
Local ready
Direct docking supported
|
|
E3L017157
BDB017157
|
US10280149, Example 67
CC(O)c1cc(C(=O)C2CCCN(CC3CC3)C2)cc2ccccc12
|
C22H27NO2 337.463000 |
XSYUMUHAYHDMSE-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383558; PubChem:CID121479006
|
Local ready
Direct docking supported
|
|
E3L017158
BDB017158
|
US10280149, Example 68
CCCN1CCCC(C(=O)c2cc(C(C)O)c3ccccc3c2)C1
|
C21H27NO2 325.452000 |
BUXHPJZADADCRI-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383559; PubChem:CID121478993
|
Local ready
Direct docking supported
|
|
E3L017159
BDB017159
|
US10280149, Example 69
COc1ccc2cc(C(=O)C3CCCN(CC4CCC4)C3)ccc2c1
|
C22H27NO2 337.463000 |
BOSOIPYAKRTSLL-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383560; PubChem:CID121479031
|
Local ready
Direct docking supported
|
|
E3L017160
BDB017160
|
BDBM383561
CCCN1CCCC(C(=O)c2ccc3c(C)c(C#N)ccc3c2)C1
|
C21H24N2O 320.436000 |
ISAYTCQDSBMWDK-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383561; PubChem:CID121479371
|
Local ready
Direct docking supported
|