| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L017161
BDB017161
|
BDBM383562
Cc1c(C#N)ccc2cc(C(=O)C3CCCN(CC4CC4)C3)ccc12
|
C22H24N2O 332.447000 |
MMSBPKZLEBKQAN-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383562; PubChem:CID121478985
|
Local ready
Direct docking supported
|
|
E3L017162
BDB017162
|
BDBM383563
Cc1c(C#N)ccc2cc(C(=O)C3CCCN(C4CCC4)C3)ccc12
|
C22H24N2O 332.447000 |
XMZLYKSIQWSTJK-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383563; PubChem:CID121478988
|
Local ready
Direct docking supported
|
|
E3L017163
BDB017163
|
BDBM383564
Cc1c(C#N)ccc2cc(C(=O)C3CCCN(C4CCCC4)C3)ccc12
|
C23H26N2O 346.474000 |
QUVOVHSTQMXZNZ-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383564; PubChem:CID121479374
|
Local ready
Direct docking supported
|
|
E3L017164
BDB017164
|
(1-Ethyl-3-piperidyl)-(6-methoxy-2-naphthyl)methanone
CCN1CCCC(C(=O)c2ccc3cc(OC)ccc3c2)C1
|
C19H23NO2 297.398000 |
DTOQWTMMDGZSKA-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383565; PubChem:CID121473765
|
Local ready
Direct docking supported
|
|
E3L017165
BDB017165
|
BDBM383567
COc1ccc2cc(C(=O)C3CCCN(CC4CC4)C3)ccc2c1
|
C21H25NO2 323.436000 |
FRZXPZFVZUQQHN-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383567; PubChem:CID45220471
|
Local ready
Direct docking supported
|
|
E3L017166
BDB017166
|
US10280149, Example 78
COCCN1CCCC(C(=O)c2ccc3cc(OC)ccc3c2)C1
|
C20H25NO3 327.424000 |
DXOJVWOWXZOUSZ-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383568; PubChem:CID134195566
|
Local ready
Direct docking supported
|
|
E3L017167
BDB017167
|
US10280149, Example 79
COc1ccc2cc(C(=O)C3CCCN(CCF)C3)ccc2c1
|
C19H22FNO2 315.388000 |
PYVFIXHCCIXHMT-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383569; PubChem:CID121479372
|
Local ready
Direct docking supported
|
|
E3L017168
BDB017168
|
BDBM383570
COc1ccc2cc(C(=O)C3CCCN(C(C)C)C3)ccc2c1
|
C20H25NO2 311.425000 |
XXFSZOWYHINCQA-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383570; PubChem:CID121478987
|
Local ready
Direct docking supported
|
|
E3L017169
BDB017169
|
BDBM383571
COc1ccc2cc(C(=O)C3CCCN(CCC#N)C3)ccc2c1
|
C20H22N2O2 322.408000 |
LEXZKTSZQPMJRL-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383571; PubChem:CID121479007
|
Local ready
Direct docking supported
|
|
E3L017170
BDB017170
|
BDBM383572
COc1ccc2cc(C(=O)C3CCCN(CC#N)C3)ccc2c1
|
C19H20N2O2 308.381000 |
SONHYDHUUQKSFB-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383572; PubChem:CID121479158
|
Local ready
Direct docking supported
|
|
E3L017171
BDB017171
|
US10280149, Example 90
CCCN1CCCC(C(=O)c2cccc(N(C)C)c2)C1
|
C17H26N2O 274.408000 |
QPBQWQIPONBBLZ-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383573; PubChem:CID121479129
|
Local ready
Direct docking supported
|
|
E3L017172
BDB017172
|
(4-Chlorophenyl)-(1-propyl-3-piperidyl)methanone
CCCN1CCCC(C(=O)c2ccc(Cl)cc2)C1
|
C15H20ClNO 265.784000 |
LAXGGHZCRJDGBQ-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383574; PubChem:CID121479162
|
Local ready
Direct docking supported
|
|
E3L017173
BDB017173
|
(3-Chlorophenyl)-(1-propyl-3-piperidyl)methanone
CCCN1CCCC(C(=O)c2cccc(Cl)c2)C1
|
C15H20ClNO 265.784000 |
DZUJVMXTUWWBQB-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383575; PubChem:CID121479155
|
Local ready
Direct docking supported
|
|
E3L017174
BDB017174
|
(1-Methylindazol-5-yl)-(1-propyl-3-piperidyl)methanone
CCCN1CCCC(C(=O)c2ccc3c(cnn3C)c2)C1
|
C17H23N3O 285.391000 |
XLELDBBUARCFHQ-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383576; PubChem:CID121479159
|
Local ready
Direct docking supported
|
|
E3L017175
BDB017175
|
(3-Benzyloxyphenyl)-(1-propyl-3-piperidyl)methanone
CCCN1CCCC(C(=O)c2cccc(OCc3ccccc3)c2)C1
|
C22H27NO2 337.463000 |
BMXICOFNSJMIOD-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383577; PubChem:CID121478941
|
Local ready
Direct docking supported
|
|
E3L017176
BDB017176
|
(4-Methoxyphenyl)-(1-propyl-3-piperidyl)methanone
CCCN1CCCC(C(=O)c2ccc(OC)cc2)C1
|
C16H23NO2 261.365000 |
SOYMFIQBTVJIAZ-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383578; PubChem:CID121473746
|
Local ready
Direct docking supported
|
|
E3L017177
BDB017177
|
(3-Methoxyphenyl)-(1-propyl-3-piperidyl)methanone
CCCN1CCCC(C(=O)c2cccc(OC)c2)C1
|
C16H23NO2 261.365000 |
AIJNXVRERAJXKD-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383579; PubChem:CID121478938
|
Local ready
Direct docking supported
|
|
E3L017178
BDB017178
|
(2-Methoxyphenyl)-(1-propyl-3-piperidyl)methanone
CCCN1CCCC(C(=O)c2ccccc2OC)C1
|
C16H23NO2 261.365000 |
LZKBJGMGXHAPIB-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383580; PubChem:CID121478937
|
Local ready
Direct docking supported
|
|
E3L017179
BDB017179
|
BDBM383581
CCCN1CCCC(C(=O)c2ccc(C(F)(F)F)cc2)C1
|
C16H20F3NO 299.336000 |
ONHZTSQVBZXLAE-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383581; PubChem:CID121478940
|
Local ready
Direct docking supported
|
|
E3L017180
BDB017180
|
(3,4-Dichlorophenyl)-(1-propyl-3-piperidyl)methanone
CCCN1CCCC(C(=O)c2ccc(Cl)c(Cl)c2)C1
|
C15H19Cl2NO 300.229000 |
NETJRKCPIHKNQU-UHFFFAOYSA-N | Q8NHM5 | Lysine-specific demethylase 2B |
BindingDB, PubChem
BindingDB:BDBM383582; PubChem:CID121478942
|
Local ready
Direct docking supported
|