| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L018161
BDB018161
|
US10570140, Example 59
Cc1ncnc2c1ccn2[C@@H]1O[C@H]([C@H](O)c2ccc(C(C)C)cc2)[C@@](C)(O)[C@H]1O
|
C22H27N3O4 397.475000 |
VQVYWOQHSIFPMT-NJKFVAIMSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM435701; PubChem:CID137479755
|
Local ready
Direct docking supported
|
|
E3L018162
BDB018162
|
US10570140, Example 60
Cc1ncnc2c1ccn2[C@@H]1O[C@H]([C@H](O)c2ccc(OC(F)(F)F)cc2)[C@@](C)(O)[C@H]1O
|
C20H20F3N3O5 439.390000 |
ZSKVLCPSGFORGC-DARIXABFSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM435702; PubChem:CID137479735
|
Local ready
Direct docking supported
|
|
E3L018163
BDB018163
|
US10570140, Example 61
Cc1ncnc2c1ccn2[C@@H]1O[C@H]([C@H](O)c2ccc(F)c(C(F)(F)F)c2)[C@@](C)(O)[C@H]1O
|
C20H19F4N3O4 441.381000 |
YUOKSWIONSHHRB-DARIXABFSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM435703; PubChem:CID137479823
|
Local ready
Direct docking supported
|
|
E3L018164
BDB018164
|
US10570140, Example 62
Cc1ncnc2c1ccn2[C@@H]1O[C@H]([C@H](O)c2ccc(C(F)(F)F)cc2)[C@@](C)(O)[C@H]1O
|
C20H20F3N3O4 423.391000 |
YXURNYCBOAWPHP-DARIXABFSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM435704; PubChem:CID137479718
|
Local ready
Direct docking supported
|
|
E3L018165
BDB018165
|
US10570140, Example 63
C[C@@]1(O)[C@@H]([C@H](O)c2ccc(F)c(C(F)(F)F)c2)O[C@@H](n2ccc3c(N)ncnc32)[C@@H]1O
|
C19H18F4N4O4 442.369000 |
NOWWVBFXXUUWKN-FOOXYVKASA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM435705; PubChem:CID137479675
|
Local ready
Direct docking supported
|
|
E3L018166
BDB018166
|
US10570140, Example 64
Cc1ncnc2c1ccn2[C@@H]1O[C@H](Cc2ccc(Cl)cc2CO)[C@@](C)(O)[C@H]1O
|
C20H22ClN3O4 403.866000 |
ZGTFXCLQCUFVNG-PIKOESSRSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM435706; PubChem:CID137479678
|
Local ready
Direct docking supported
|
|
E3L018167
BDB018167
|
US10570140, Example 65
C[C@@]1(O)[C@@H](Cc2ccc(Cl)cc2CO)O[C@@H](n2ccc3c(N)ncnc32)[C@@H]1O
|
C19H21ClN4O4 404.854000 |
HZLINOBJSJTGTA-WTLGNFPFSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM435707; PubChem:CID137479704
|
Local ready
Direct docking supported
|
|
E3L018168
BDB018168
|
US10570140, Example 66
C[C@@]1(O)C([C@@H](O)c2ccc(Cl)c(Cl)c2)O[C@@H](n2ccc3c(N)ncnc32)[C@@H]1O
|
C18H18Cl2N4O4 425.272000 |
NVZVVFMXEHOMQR-HWQRRKCRSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM435708; PubChem:CID148704486
|
Local ready
Direct docking supported
|
|
E3L018169
BDB018169
|
US10570140, Example 67
Cc1ncnc2c1ccn2[C@@H]1O[C@H](COc2ccn3c(C)cnc3c2)[C@@](C)(O)[C@H]1O
|
C21H23N5O4 409.446000 |
HADKMWKTGHTOQQ-XRULBBBTSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM435709; PubChem:CID137479671
|
Local ready
Direct docking supported
|
|
E3L018170
BDB018170
|
US10570140, Example 68
Cc1cnc2cc(OC[C@H]3O[C@@H](n4ccc5c(N)ncnc54)[C@H](O)[C@]3(C)O)ccn12
|
C20H22N6O4 410.434000 |
XGNCIUCSKJERPK-HIBPSGHXSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM435710; PubChem:CID137479668
|
Local ready
Direct docking supported
|
|
E3L018171
BDB018171
|
US10590075, Example 1
N#CN1CCC(F)(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1
|
C13H10ClF4N3O 335.688000 |
WCODAHHDYHWBAC-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM436051; PubChem:CID129285197
|
Local ready
Direct docking supported
|
|
E3L018172
BDB018172
|
US10590075, Example 2
N#CN1CCC(F)(C(=O)Nc2nc(-c3ccccc3)cs2)C1
|
C15H13FN4OS 316.361000 |
XWJPDZIVYGNBAR-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM436053; PubChem:CID129285262
|
Local ready
Direct docking supported
|
|
E3L018173
BDB018173
|
US10590075, Example 3
N#CN1CCC(F)(C(=O)Nc2ccc3ncsc3c2)C1
|
C13H11FN4OS 290.323000 |
FEWAQVWHYPOHFV-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM436054; PubChem:CID137358388
|
Local ready
Direct docking supported
|
|
E3L018174
BDB018174
|
BDBM436057
N#CN1CCC(F)(C(=O)Nc2cnc3ccccc3c2)C1
|
C15H13FN4O 284.294000 |
DPWJFZSUUNMKOT-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM436057; PubChem:CID129285121
|
Local ready
Direct docking supported
|
|
E3L018175
BDB018175
|
BDBM436058
N#CN1CCC(F)(C(=O)Nc2ccc3ncccc3c2)C1
|
C15H13FN4O 284.294000 |
NPANYYNLECHSPH-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM436058; PubChem:CID129285248
|
Local ready
Direct docking supported
|
|
E3L018176
BDB018176
|
US10590075, Example 6
Cc1nc(-c2cccc(NC(=O)C3(F)CCN(C#N)C3)c2)cs1
|
C16H15FN4OS 330.388000 |
KMMCJHZDMNJFQJ-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM436059; PubChem:CID137358384
|
Local ready
Direct docking supported
|
|
E3L018177
BDB018177
|
US10590075, Example 7
N#CN1CCC(F)(C(=O)Nc2cccc(Oc3ccccc3)c2)C1
|
C18H16FN3O2 325.343000 |
KNBLJWUSPMIRPH-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM436062; PubChem:CID129285282
|
Local ready
Direct docking supported
|
|
E3L018178
BDB018178
|
US10590075, Example 8
N#CN1CCC(F)(C(=O)Nc2ncc(-c3ccccc3)s2)C1
|
C15H13FN4OS 316.361000 |
FWOJFVNNHZFPJX-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM436063; PubChem:CID129285272
|
Local ready
Direct docking supported
|
|
E3L018179
BDB018179
|
US10590075, Example 9
N#CN1CC[C@](F)(C(=O)Nc2ncc(-c3ccccc3)s2)C1
|
C15H13FN4OS 316.361000 |
FWOJFVNNHZFPJX-OAHLLOKOSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM436064; PubChem:CID129301845
|
Local ready
Direct docking supported
|
|
E3L018180
BDB018180
|
US10590075, Example 10
N#CN1CCC(F)(C(=O)Nc2cc(-c3ccccc3)on2)C1
|
C15H13FN4O2 300.293000 |
KASDLCBIWMCJCT-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM436066; PubChem:CID129285361
|
Local ready
Direct docking supported
|