| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L023061
BDB023061
|
BDBM533442
CCO/N=c1/[nH]cnc2c1ccn2[C@@H]1O[C@H]([C@H](O)c2ccc(Cl)c(Cl)c2)[C@@H](O)[C@H]1O
|
C19H20Cl2N4O5 455.298000 |
ZYHQRCUTLQBIMQ-PPLBCVRQSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM533442; PubChem:CID135307420
|
Local ready
Direct docking supported
|
|
E3L023062
BDB023062
|
BDBM533443
CCO/N=c1\nc[nH]c2c1ccn2[C@@H]1O[C@H]([C@](C)(O)c2ccc(Cl)cc2)[C@@H](O)[C@H]1O
|
C20H23ClN4O5 434.880000 |
KWIOEMTZPKAQPU-HRYJEPKJSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM533443; PubChem:CID156334481
|
Local ready
Direct docking supported
|
|
E3L023063
BDB023063
|
US11220509, Example 70
N#Cc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3cnc(C4CC4)nc3)c2n1
|
C23H18FN7O 427.443000 |
HMDQHNMOZKSKGU-UHFFFAOYSA-N | O75530, Q09028 | Histone-lysine N-methyltransferase EZH2 |
BindingDB, PubChem
BindingDB:BDBM533444; PubChem:CID156050898
|
Local ready
Direct docking supported
|
|
E3L023064
BDB023064
|
BDBM533445
CO/N=c1\[nH]cnc2c1ncn2[C@@H]1O[C@H]([C@](C)(O)c2ccc(Cl)c(Cl)c2)[C@@H](O)[C@H]1O
|
C18H19Cl2N5O5 456.286000 |
MTJCHKWJANVQIN-IZOOLLGQSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM533445; PubChem:CID154029224
|
Local ready
Direct docking supported
|
|
E3L023065
BDB023065
|
BDBM533447
CCO/N=c1\[nH]cnc2c1ncn2[C@@H]1O[C@H]([C@](C)(O)c2ccc(Cl)c(Cl)c2)[C@@H](O)[C@H]1O
|
C19H21Cl2N5O5 470.313000 |
SOFIEKAPPASUHX-LTFPAQTLSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM533447; PubChem:CID156311522
|
Local ready
Direct docking supported
|
|
E3L023066
BDB023066
|
BDBM533448
CO/N=c1\[nH]cnc2c1ncn2[C@@H]1O[C@H]([C@](C)(O)c2ccc(Cl)c(C)c2)[C@@H](O)[C@H]1O
|
C19H22ClN5O5 435.868000 |
INFVRUKRERDCEJ-LTFPAQTLSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM533448; PubChem:CID154029229
|
Local ready
Direct docking supported
|
|
E3L023067
BDB023067
|
BDBM533449
CCO/N=c1\[nH]cnc2c1ncn2[C@@H]1O[C@H]([C@](C)(O)c2ccc(Cl)c(C)c2)[C@@H](O)[C@H]1O
|
C20H24ClN5O5 449.895000 |
WZVNKUZQQYTZEC-HRYJEPKJSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM533449; PubChem:CID154029230
|
Local ready
Direct docking supported
|
|
E3L023068
BDB023068
|
BDBM533453
CCO/N=c1\nc[nH]c2c1ccn2[C@@H]1O[C@H]([C@H](O)c2ccc(Cl)cc2)[C@@H](O)[C@H]1O
|
C19H21ClN4O5 420.853000 |
YTLQXDRQINYMCQ-PPLBCVRQSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM533453; PubChem:CID135307553
|
Local ready
Direct docking supported
|
|
E3L023069
BDB023069
|
BDBM533454
CO/N=c1\nc[nH]c2c1ccn2[C@@H]1O[C@H]([C@H](O)c2ccc(C(F)(F)F)c(C)c2)[C@@H](O)[C@H]1O
|
C20H21F3N4O5 454.405000 |
LAEYVCMVWKYXNL-PPLBCVRQSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM533454; PubChem:CID135307498
|
Local ready
Direct docking supported
|
|
E3L023070
BDB023070
|
US11220524, Example 99
CCO/N=c1/nc[nH]c2c1ccn2[C@@H]1O[C@H]([C@](C)(O)c2ccc(Cl)c(Cl)c2)[C@@H](O)[C@H]1O
|
C20H22Cl2N4O5 469.325000 |
QSWFOYVXGNRPRC-HRYJEPKJSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM533455; PubChem:CID135307510
|
Local ready
Direct docking supported
|
|
E3L023071
BDB023071
|
BDBM533457
CO/N=c1\nc[nH]c2c1c(CCO)cn2[C@@H]1O[C@H]([C@H](O)c2ccc(Cl)c(Cl)c2)[C@@H](O)[C@H]1O
|
C20H22Cl2N4O6 485.324000 |
PTFNNSXKASKNON-QRXRQMIZSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM533457; PubChem:CID135307626
|
Local ready
Direct docking supported
|
|
E3L023072
BDB023072
|
BDBM533458
C#Cc1cn([C@@H]2O[C@H]([C@H](O)c3ccc(Cl)cc3)[C@@H](O)[C@H]2O)c2[nH]cn/c(=N\OC)c12
|
C20H19ClN4O5 430.848000 |
SYMWKQKVRYOYLO-QRXRQMIZSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM533458; PubChem:CID135307502
|
Local ready
Direct docking supported
|
|
E3L023073
BDB023073
|
BDBM533460
CO/N=c1\nc[nH]c2c1ccn2[C@@H]1O[C@H]([C@H](OC)c2ccc(Cl)c(F)c2)[C@@H](O)[C@H]1O
|
C19H20ClFN4O5 438.843000 |
INBCXOLCERZRTM-IPXJXJKCSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM533460; PubChem:CID135307471
|
Local ready
Direct docking supported
|
|
E3L023074
BDB023074
|
BDBM533461
O[C@@H]1[C@H](O)[C@@H]([C@H](O)c2ccc(Cl)c(Cl)c2)O[C@H]1n1ccc2/c(=N/OCC(F)(F)F)nc[nH]c21
|
C19H17Cl2F3N4O5 509.268000 |
MGSHKRIIABUSCJ-KQVLKZGSSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM533461; PubChem:CID135307589
|
Local ready
Direct docking supported
|
|
E3L023075
BDB023075
|
BDBM533463
C#Cc1cn([C@@H]2O[C@H]([C@H](O)c3ccc(Cl)c(Cl)c3)[C@@H](O)[C@H]2O)c2[nH]cn/c(=N\OC)c12
|
C20H18Cl2N4O5 465.293000 |
WIPONRQAVGXVBZ-QRXRQMIZSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM533463; PubChem:CID135307549
|
Local ready
Direct docking supported
|
|
E3L023076
BDB023076
|
BDBM533464
C[C@@](O)(C1C=C(Cl)C(Cl)=CC1)[C@H]1O[C@@H](n2ccc3/c(=N\O)nc[nH]c32)[C@H](O)[C@@H]1O
|
C18H20Cl2N4O5 443.287000 |
XXYWLEVHJQGNLG-JVKLTQNRSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM533464; PubChem:CID155169713
|
Local ready
Direct docking supported
|
|
E3L023077
BDB023077
|
BDBM533466
O[C@@H]1[C@H](O)[C@@H]([C@H](O)c2ccc(Cl)c(Cl)c2)O[C@H]1n1ccc2/c(=N/OCC(F)F)nc[nH]c21
|
C19H18Cl2F2N4O5 491.278000 |
YXCDHKKXINHAMP-PPLBCVRQSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM533466; PubChem:CID155175363
|
Local ready
Direct docking supported
|
|
E3L023078
BDB023078
|
BDBM533468
CO/N=c1\nc[nH]c2c1c(F)cn2[C@@H]1O[C@H]([C@](C)(O)c2ccc(Cl)c(Cl)c2)[C@@H](O)[C@H]1O
|
C19H19Cl2FN4O5 473.288000 |
FTYSYXFESRRYIH-LTFPAQTLSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM533468; PubChem:CID155169747
|
Local ready
Direct docking supported
|
|
E3L023079
BDB023079
|
BDBM533469
C[C@@](O)(c1ccc(Cl)c(Cl)c1)[C@H]1O[C@@H](n2ccc3/c(=N/O)nc[nH]c32)[C@H](O)[C@@H]1O
|
C18H18Cl2N4O5 441.271000 |
GAFFRVOQKBCJAR-IZOOLLGQSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM533469; PubChem:CID156334599
|
Local ready
Direct docking supported
|
|
E3L023080
BDB023080
|
US11220524, Example 25-B
N/N=c1/nc[nH]c2c1ccn2[C@@H]1C[C@H]([C@H](O)c2ccc(Cl)cc2)[C@@H](O)[C@H]1O
|
C18H20ClN5O3 389.843000 |
JKJXRCXBHKSCNR-QCODTGAPSA-N | Q9BQA1 | Protein arginine N-methyltransferase 5 |
BindingDB, PubChem
BindingDB:BDBM533470; PubChem:CID155169662
|
Local ready
Direct docking supported
|