| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L024461
BDB024461
|
US11274098, Example 11
O=C(NCC(O)CN1CCc2c([nH]c3ccccc23)C1)c1cc(NC2CCC2)ncn1
|
C23H28N6O2 420.517000 |
MOZRQAGODHFUAK-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542497; PubChem:CID135330786
|
Local ready
Direct docking supported
|
|
E3L024462
BDB024462
|
US11274098, Example 12
CC(=O)N1CCC(Nc2cc(C(=O)NCC(O)CN3CCc4c([nH]c5ccccc45)C3)ncn2)CC1
|
C26H33N7O3 491.596000 |
RUILVENRLKOEQO-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542498; PubChem:CID153407348
|
Local ready
Direct docking supported
|
|
E3L024463
BDB024463
|
US11274098, Example 13
O=C(NCC(O)CN1CCc2c([nH]c3ccccc23)C1)c1ccc(C(=O)N2CCOCC2)cc1
|
C26H30N4O4 462.550000 |
PDHVRMGIMXWJJB-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542499; PubChem:CID135330788
|
Local ready
Direct docking supported
|
|
E3L024464
BDB024464
|
US11274098, Example 14
O=C(NCC(O)CN1CCc2c([nH]c3ccccc23)C1)c1ccc(C(=O)N2C3CCC2COC3)cc1
|
C28H32N4O4 488.588000 |
CYMRXKIMQAVJSB-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542500; PubChem:CID142428459
|
Local ready
Direct docking supported
|
|
E3L024465
BDB024465
|
US11274098, Example 15
CN1CCN(c2nc(NC3CCC3)cc(C(=O)NCC(O)CN3CCc4c(n(C)c5ccccc45)C3)n2)CC1
|
C29H40N8O2 532.693000 |
WCZWGRKVCRLYNV-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542501; PubChem:CID142428466
|
Local ready
Direct docking supported
|
|
E3L024466
BDB024466
|
US11274098, Example 16
CN1CCN(c2cc(C(=O)NCC(O)CN3CCc4c(n(C)c5ccccc45)C3)cc(NC3CCC3)n2)CC1
|
C30H41N7O2 531.705000 |
YSSKGIBHSZRISP-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542502; PubChem:CID135330860
|
Local ready
Direct docking supported
|
|
E3L024467
BDB024467
|
US11274098, Example 17
Cn1c2c(c3ccccc31)CCN(CC(O)CNC(=O)c1cc(NC3CCC3)ncn1)C2
|
C24H30N6O2 434.544000 |
XJIOMULCJVBILZ-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542503; PubChem:CID142428456
|
Local ready
Direct docking supported
|
|
E3L024468
BDB024468
|
US11274098, Example 18
CC(=O)N1CCC(Nc2cc(C(=O)NCC(O)CN3CCc4c(n(C)c5ccccc45)C3)ncn2)CC1
|
C27H35N7O3 505.623000 |
YQFQACQEUDFVOC-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542504; PubChem:CID135330809
|
Local ready
Direct docking supported
|
|
E3L024469
BDB024469
|
US11274098, Example 19
Cn1c2c(c3ccccc31)CCN(CC(O)CNC(=O)c1ccc(C(=O)N3C4CCC3COC4)cc1)C2
|
C29H34N4O4 502.615000 |
CAMABNYAOJETNP-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542505; PubChem:CID142428454
|
Local ready
Direct docking supported
|
|
E3L024470
BDB024470
|
US11274098, Example 20
O=C(OCC(O)CN1CCc2c([nH]c3ccccc23)C1)N1CCC(c2ccccc2)C1
|
C25H29N3O3 419.525000 |
HINOGIPUFJLPAK-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542506; PubChem:CID142428498
|
Local ready
Direct docking supported
|
|
E3L024471
BDB024471
|
US11274098, Example 21
O=C(OCC(O)CN1CCc2c([nH]c3ccccc23)C1)N1CCc2ccccc2C1
|
C24H27N3O3 405.498000 |
FNDQIFHBWJDKML-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542507; PubChem:CID135331672
|
Local ready
Direct docking supported
|
|
E3L024472
BDB024472
|
US11274098, Example 22
O=C(NCC(O)CN1CCc2c([nH]c3ccccc23)C1)N1CCc2ccccc2C1
|
C24H28N4O2 404.514000 |
IJXFUGSRMZWZTG-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542508; PubChem:CID142428458
|
Local ready
Direct docking supported
|
|
E3L024473
BDB024473
|
US11274098, Example 23
O=C(NCC(O)CN1CCc2c([nH]c3ccccc23)C1)N1CCC(c2ccccc2)C1
|
C25H30N4O2 418.541000 |
VXTOIHWDEBRQSW-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542509; PubChem:CID135331668
|
Local ready
Direct docking supported
|
|
E3L024474
BDB024474
|
US11274098, Example 24
O=C(NCC(O)CN1CCc2c([nH]c3ccccc23)C1)N1CCCC(c2ccccc2)C1
|
C26H32N4O2 432.568000 |
FDDDLKYUJOYUPP-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542510; PubChem:CID142428486
|
Local ready
Direct docking supported
|
|
E3L024475
BDB024475
|
US11274098, Example 25
CC(=O)N1CCC(Nc2cc(C(=O)NCCCN3CCc4c([nH]c5ccccc45)C3)ncn2)CC1
|
C26H33N7O2 475.597000 |
HEIZPOCMYASBQF-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542511; PubChem:CID142428438
|
Local ready
Direct docking supported
|
|
E3L024476
BDB024476
|
US11274098, Example 26
CC(=O)N1CCC(Nc2cc(C(=O)NC[C@H](O)CN3CCc4c([nH]c5ccccc45)C3)ncn2)CC1
|
C26H33N7O3 491.596000 |
RUILVENRLKOEQO-IBGZPJMESA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542512; PubChem:CID153407345
|
Local ready
Direct docking supported
|
|
E3L024477
BDB024477
|
US11274098, Example 27
CC(=O)N1CCC(Nc2cc(C(=O)NC[C@@H](O)CN3CCc4c([nH]c5ccccc45)C3)ncn2)CC1
|
C26H33N7O3 491.596000 |
RUILVENRLKOEQO-LJQANCHMSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542513; PubChem:CID153407344
|
Local ready
Direct docking supported
|
|
E3L024478
BDB024478
|
US11274098, Example 28
CC(=O)N1CCC(Nc2cc(C(=O)NCC(O)CN3CCn4c(cc5ccccc54)C3)ncn2)CC1
|
C26H33N7O3 491.596000 |
FWEDLOSNMZRUNG-UHFFFAOYSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM542514; PubChem:CID153407347
|
Local ready
Direct docking supported
|
|
E3L024479
BDB024479
|
US11292791, Example 1
COC(=O)N1c2ccc3c(nc(C[C@@H](C)c4ccccc4)n3C)c2CC[C@@H]1C
|
C23H27N3O2 377.488000 |
YSFDUTVDXNSFGB-CVEARBPZSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM546722; PubChem:CID138479657
|
Local ready
Direct docking supported
|
|
E3L024480
BDB024480
|
US11292791, Example 2
COC(=O)N1c2ccc3c(nc(C[C@H](C)c4ccccc4)n3C)c2CC[C@@H]1C
|
C23H27N3O2 377.488000 |
YSFDUTVDXNSFGB-HOTGVXAUSA-N | Q92793 | CREB-binding protein |
BindingDB, PubChem
BindingDB:BDBM546723; PubChem:CID138479656
|
Local ready
Direct docking supported
|