| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L025641
BDB025641
|
US10669234, Example 28
N#CN1CC(F)(F)C[C@H]1C(=O)N1CCc2c(-c3c[nH]nc3C(F)(F)F)cccc21
|
C18H14F5N5O 411.334000 |
BHILSXATFZMXGG-AWEZNQCLSA-N | P09936 | Ubiquitin carboxyl-terminal hydrolase isozyme L1 |
BindingDB, PubChem
BindingDB:BDBM552973; PubChem:CID135205478
|
Local ready
Direct docking supported
|
|
E3L025642
BDB025642
|
(2S,4S)-4-fluoro-2-(4-(5-
N#CN1CC(F)C[C@H]1C(=O)N1CCc2c(-c3c[nH]nc3C(F)(F)F)cccc21
|
C18H15F4N5O 393.344000 |
AHCBJXSHVXHGHF-WRXSAAJRSA-N | P09936 | Ubiquitin carboxyl-terminal hydrolase isozyme L1 |
BindingDB, PubChem
BindingDB:BDBM552974; PubChem:CID164607828
|
Local ready
Direct docking supported
|
|
E3L025643
BDB025643
|
US11319299, Example 27
CC(=O)Nc1cc(C(F)(F)F)c(C(=O)Nc2cc(-c3cnc(N4CCOCC4)nc3)c(F)cc2N2C[C@@H](C)N(C)[C@@H](C)C2)cn1
|
C30H34F4N8O3 630.647000 |
WEPWHMCRXBMMJW-HDICACEKSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM552976; PubChem:CID138542084
|
Local ready
Direct docking supported
|
|
E3L025644
BDB025644
|
US11319299, Example 28
Cc1cc(C(=O)Nc2cc(-c3cnc(N4CCOCC4)nc3)c(F)cc2N2C[C@@H](C)N(C)[C@@H](C)C2)cc(C)c1F
|
C30H36F2N6O2 550.654000 |
HZHCCOARFZTFNJ-OYRHEFFESA-N | P61964, Q03164, Q15291, Q969U6 | Histone-lysine N-methyltransferase 2A, WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM552977; PubChem:CID137377101
|
Local ready
Direct docking supported
|
|
E3L025645
BDB025645
|
BDBM552978
C[C@@H]1CN(c2cc(F)c(-c3ccc(N4CCOCC4)cc3)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)C[C@H](C)N1C
|
C30H33F4N5O3 587.618000 |
RERINPGTUQBMDR-KDURUIRLSA-N | P61964, Q03164, Q15291, Q969U6 | Histone-lysine N-methyltransferase 2A, WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM552978; PubChem:CID137377246
|
Local ready
Direct docking supported
|
|
E3L025646
BDB025646
|
US11319287, Example 34
N#CN1CCC[C@H]1C(=O)N1Cc2cccc(-c3ccccn3)c2C1
|
C19H18N4O 318.380000 |
JFHMYQLJHAVTGE-SFHVURJKSA-N | P09936 | Ubiquitin carboxyl-terminal hydrolase isozyme L1 |
BindingDB, PubChem
BindingDB:BDBM552979; PubChem:CID164607830
|
Local ready
Direct docking supported
|
|
E3L025647
BDB025647
|
BDBM552980
CN1CCN(c2cc(F)c(-c3ccc(OC4CCOCC4)nc3)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)CC1
|
C28H29F4N5O4 575.563000 |
ZXNZFLDTEWCDMC-UHFFFAOYSA-N | P61964, Q03164, Q15291, Q969U6 | Histone-lysine N-methyltransferase 2A, WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM552980; PubChem:CID137376979
|
Local ready
Direct docking supported
|
|
E3L025648
BDB025648
|
BDBM552981
C[C@@H]1CN(c2cc(F)c(-c3cnc(C#N)nc3)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)C[C@H](C)N1C
|
C25H23F4N7O2 529.498000 |
QCTQIUVBBPESJQ-OKILXGFUSA-N | P61964, Q03164, Q15291, Q969U6 | Histone-lysine N-methyltransferase 2A, WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM552981; PubChem:CID137376874
|
Local ready
Direct docking supported
|
|
E3L025649
BDB025649
|
BDBM552982
C[C@@H]1CN(c2cc(F)c(-c3ccc(N4CCOCC4)nc3)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)C[C@H](C)N1C
|
C29H32F4N6O3 588.606000 |
GBEYGHHOGZXQCC-HDICACEKSA-N | P61964, Q03164, Q15291, Q969U6 | Histone-lysine N-methyltransferase 2A, WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM552982; PubChem:CID137376919
|
Local ready
Direct docking supported
|
|
E3L025650
BDB025650
|
BDBM552983
Cc1ncc(-c2cc(NC(=O)c3c[nH]c(=O)cc3C(F)(F)F)c(N3C[C@@H](C)N(C)[C@@H](C)C3)cc2F)cn1
|
C25H26F4N6O2 518.515000 |
NSDXRTZOEXSSPU-OKILXGFUSA-N | P61964, Q03164, Q15291, Q969U6 | Histone-lysine N-methyltransferase 2A, WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM552983; PubChem:CID138541623
|
Local ready
Direct docking supported
|
|
E3L025651
BDB025651
|
BDBM552984
C[C@@H]1CN(c2cc(F)c(-c3cnc(N4CCOCC4)nc3)cc2NC(=O)c2c[nH]c(=O)cc2C(F)F)C[C@H](C)N1C
|
C28H32F3N7O3 571.604000 |
UUCBZFVZRYUNFK-CALCHBBNSA-N | P61964, Q03164, Q15291, Q969U6 | WD repeat-containing protein 5, Histone-lysine N-methyltransferase 2A |
BindingDB, PubChem
BindingDB:BDBM552984; PubChem:CID138541650
|
Local ready
Direct docking supported
|
|
E3L025652
BDB025652
|
BDBM552985
C[C@@H]1CN(c2cc(F)c(-c3cccnc3)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)C[C@H](C)N1C
|
C25H25F4N5O2 503.500000 |
PWIXTNXPOYAMKW-GASCZTMLSA-N | P61964, Q03164, Q15291, Q969U6 | Histone-lysine N-methyltransferase 2A, WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM552985; PubChem:CID137377131
|
Local ready
Direct docking supported
|
|
E3L025653
BDB025653
|
BDBM552986
C[C@@H]1CN(c2cc(F)c(-c3ccncc3)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)C[C@H](C)N1C
|
C25H25F4N5O2 503.500000 |
AKYZOYQVCPKNMI-GASCZTMLSA-N | P61964, Q03164, Q15291, Q969U6 | WD repeat-containing protein 5, Histone-lysine N-methyltransferase 2A |
BindingDB, PubChem
BindingDB:BDBM552986; PubChem:CID137377650
|
Local ready
Direct docking supported
|
|
E3L025654
BDB025654
|
BDBM552987
CN(C)[C@@H]1CCN(c2cc(F)c(-c3cnc(N4CCOCC4)nc3)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)C1
|
C27H29F4N7O3 575.567000 |
ZIWKHOHCZXDNQD-QGZVFWFLSA-N | P61964, Q03164, Q15291, Q969U6 | Histone-lysine N-methyltransferase 2A, WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM552987; PubChem:CID137377658
|
Local ready
Direct docking supported
|
|
E3L025655
BDB025655
|
BDBM552988
CN(C)[C@H]1CCN(c2cc(F)c(-c3cnc(N4CCOCC4)nc3)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)C1
|
C27H29F4N7O3 575.567000 |
ZIWKHOHCZXDNQD-KRWDZBQOSA-N | P61964, Q03164, Q15291, Q969U6 | WD repeat-containing protein 5, Histone-lysine N-methyltransferase 2A |
BindingDB, PubChem
BindingDB:BDBM552988; PubChem:CID137377699
|
Local ready
Direct docking supported
|
|
E3L025656
BDB025656
|
BDBM552989
C[C@@H]1CN(c2cc(F)c(-c3ccc(OCC4CC4)nc3)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)C[C@H](C)N1C
|
C29H31F4N5O3 573.591000 |
RSDNMYGQEMFEDV-CALCHBBNSA-N | P61964, Q03164, Q15291, Q969U6 | WD repeat-containing protein 5, Histone-lysine N-methyltransferase 2A |
BindingDB, PubChem
BindingDB:BDBM552989; PubChem:CID137377152
|
Local ready
Direct docking supported
|
|
E3L025657
BDB025657
|
BDBM552990
CN1CCN(c2cc(F)c(-c3cnc(N(C)C)nc3)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)CC1
|
C24H25F4N7O2 519.503000 |
ZHYKLPAWOLFHNY-UHFFFAOYSA-N | P61964, Q03164, Q15291, Q969U6 | Histone-lysine N-methyltransferase 2A, WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM552990; PubChem:CID137377055
|
Local ready
Direct docking supported
|
|
E3L025658
BDB025658
|
BDBM552991
CN1CCN(c2cc(F)c(-c3ccc(CN4CCOCC4)nc3)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)CC1
|
C28H30F4N6O3 574.579000 |
VJABKHXVGPQFCN-UHFFFAOYSA-N | P61964, Q03164, Q15291, Q969U6 | WD repeat-containing protein 5, Histone-lysine N-methyltransferase 2A |
BindingDB, PubChem
BindingDB:BDBM552991; PubChem:CID138542206
|
Local ready
Direct docking supported
|
|
E3L025659
BDB025659
|
US11319299, Example 42
C[C@@H]1CN(c2cc(F)c(-c3cnc(N4CCOCC4)nc3)cc2NC(=O)c2c[nH]nc2C(F)(F)F)C[C@H](C)N1C
|
C26H30F4N8O2 562.572000 |
WALRNPLEOSYAFU-IYBDPMFKSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM552992; PubChem:CID137377675
|
Local ready
Direct docking supported
|
|
E3L025660
BDB025660
|
BDBM552994
CN1CCN(c2cc(F)c(-c3cccc(CNC4CCCC4)c3)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)CC1
|
C30H33F4N5O2 571.619000 |
MKLAJKBTIBKWMV-UHFFFAOYSA-N | P61964, Q03164, Q15291, Q969U6 | WD repeat-containing protein 5, Histone-lysine N-methyltransferase 2A |
BindingDB, PubChem
BindingDB:BDBM552994; PubChem:CID138541761
|
Local ready
Direct docking supported
|