| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L063381
BDB063381
|
BDBM50616740
O=C1C(Cl)=C(NCCC2(O)CCN(C(=O)C3CC3(F)F)CC2)C(=O)c2ncccc21
|
C20H20ClF2N3O4 439.846000 |
MFRUOYMNNALBDU-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50616740; PubChem:CID172452936
|
Local ready
Direct docking supported
|
|
E3L063382
BDB063382
|
BDBM50616741
O=C1C(NCCC2(O)CCN(C(=O)C3CC3(F)F)CC2)=C(Cl)C(=O)c2ncccc21
|
C20H20ClF2N3O4 439.846000 |
OGFBLOLLFBNITG-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50616741; PubChem:CID172440942
|
Local ready
Direct docking supported
|
|
E3L063383
BDB063383
|
BDBM50616742
C[C@@](O)(C(=O)N1CCC(O)(CCNC2=C(Cl)C(=O)c3cccnc3C2=O)CC1)C(F)(F)F
|
C20H21ClF3N3O5 475.851000 |
WEFIEAQCGYECIG-GOSISDBHSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50616742; PubChem:CID172458413
|
Local ready
Direct docking supported
|
|
E3L063384
BDB063384
|
BDBM50616743
C[C@@](O)(C(=O)N1CCC(O)(CCNC2=C(Cl)C(=O)c3ncccc3C2=O)CC1)C(F)(F)F
|
C20H21ClF3N3O5 475.851000 |
SQBZRQOYHKHXQB-GOSISDBHSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50616743; PubChem:CID172453970
|
Local ready
Direct docking supported
|
|
E3L063385
BDB063385
|
BDBM50616744
CC(F)(F)C(=O)NC1CN(C2=C(Cl)C(=O)c3cccnc3C2=O)C1
|
C15H12ClF2N3O3 355.728000 |
BWMVLHCKQMCJJC-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50616744; PubChem:CID172455904
|
Local ready
Direct docking supported
|
|
E3L063386
BDB063386
|
BDBM50616745
CC(F)(F)C(=O)NC1CN(C2=C(Cl)C(=O)c3ncccc3C2=O)C1
|
C15H12ClF2N3O3 355.728000 |
TXUNBKRIGDLXFX-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50616745; PubChem:CID172442379
|
Local ready
Direct docking supported
|
|
E3L063387
BDB063387
|
BDBM50616746
CC#CC(=O)NC1CN(C2=C(Cl)C(=O)c3cccnc3C2=O)C1
|
C16H12ClN3O3 329.743000 |
GPMPDGCIIQGNGE-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50616746; PubChem:CID172441674
|
Local ready
Direct docking supported
|
|
E3L063388
BDB063388
|
BDBM50616747
CC#CC(=O)NC1CN(C2=C(Cl)C(=O)c3ncccc3C2=O)C1
|
C16H12ClN3O3 329.743000 |
DOYQVMPICFMBAO-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50616747; PubChem:CID172467450
|
Local ready
Direct docking supported
|
|
E3L063389
BDB063389
|
BDBM50616748
CC(F)(F)C(=O)N1CCC2(CC1)CN(C1=C(Cl)C(=O)c3cccnc3C1=O)C2
|
C19H18ClF2N3O3 409.820000 |
NPNMKTVTHWULLL-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50616748; PubChem:CID172461181
|
Local ready
Direct docking supported
|
|
E3L063390
BDB063390
|
BDBM50616749
CC(F)(F)C(=O)N1CCC2(CC1)CN(C1=C(Cl)C(=O)c3ncccc3C1=O)C2
|
C19H18ClF2N3O3 409.820000 |
BYNCITOIAHZHDY-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50616749; PubChem:CID172444855
|
Local ready
Direct docking supported
|
|
E3L063391
BDB063391
|
BDBM50616750
CC#CC(=O)N1CCC2(CC1)CN(C1=C(Cl)C(=O)c3cccnc3C1=O)C2
|
C20H18ClN3O3 383.835000 |
YDIINXBBPNTGSJ-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50616750; PubChem:CID172459409
|
Local ready
Direct docking supported
|
|
E3L063392
BDB063392
|
BDBM50616751
CC#CC(=O)N1CCC2(CC1)CN(C1=C(Cl)C(=O)c3ncccc3C1=O)C2
|
C20H18ClN3O3 383.835000 |
WDSMMWFAUCZTEC-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50616751; PubChem:CID172444517
|
Local ready
Direct docking supported
|
|
E3L063393
BDB063393
|
BDBM50616752
CC(F)(F)C(=O)NCCC1CCN(C2=C(Cl)C(=O)c3cccnc3C2=O)CC1
|
C19H20ClF2N3O3 411.836000 |
PJQIYVJTWMEENE-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50616752; PubChem:CID172462806
|
Local ready
Direct docking supported
|
|
E3L063394
BDB063394
|
BDBM50616753
CC(F)(F)C(=O)NCCC1CCN(C2=C(Cl)C(=O)c3ncccc3C2=O)CC1
|
C19H20ClF2N3O3 411.836000 |
IJGDDBZDJUBMTF-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50616753; PubChem:CID172450824
|
Local ready
Direct docking supported
|
|
E3L063395
BDB063395
|
BDBM50616754
CC#CC(=O)NCCC1CCN(C2=C(Cl)C(=O)c3cccnc3C2=O)CC1
|
C20H20ClN3O3 385.851000 |
FGAHKCNTZMMSIF-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50616754; PubChem:CID172447471
|
Local ready
Direct docking supported
|
|
E3L063396
BDB063396
|
BDBM50616755
CC#CC(=O)NCCC1CCN(C2=C(Cl)C(=O)c3ncccc3C2=O)CC1
|
C20H20ClN3O3 385.851000 |
IPXXLQJVFJIFFC-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50616755; PubChem:CID172439109
|
Local ready
Direct docking supported
|
|
E3L063397
BDB063397
|
BDBM50616756
CC(F)(F)C(=O)NCCC1CN(C2=C(Cl)C(=O)c3cccnc3C2=O)C1
|
C17H16ClF2N3O3 383.782000 |
KQILXJHCHUQJOK-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50616756; PubChem:CID172464780
|
Local ready
Direct docking supported
|
|
E3L063398
BDB063398
|
BDBM50616757
CC(F)(F)C(=O)NCCC1CN(C2=C(Cl)C(=O)c3ncccc3C2=O)C1
|
C17H16ClF2N3O3 383.782000 |
BYHKKNJHHWHCQV-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50616757; PubChem:CID172439759
|
Local ready
Direct docking supported
|
|
E3L063399
BDB063399
|
BDBM50617215
CC(C)[C@@H]1NC(=O)Cn2cc(nn2)C[C@@H](C(N)=O)NC(=O)[C@@H]2C[C@@H](CN2C(=O)c2ccccc2)NC(=O)[C@H](Cc2cccc(C(F)(F)F)c2)NC(=O)[C@@H](C(C)C)CNC(=O)CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O
|
C62H71F3N14O10 1229.332000 |
ZAPBZKBLKRCOOA-NGHPCPEPSA-N | O15151, Q00987 | E3 ubiquitin-protein ligase Mdm2, Protein Mdm4 |
BindingDB
BindingDB:BDBM50617215
|
Local ready
Direct docking supported
|
|
E3L063400
BDB063400
|
BDBM50617216
CC(C)[C@@H]1NC(=O)Cn2cc(nn2)C[C@H](C(N)=O)NC(=O)[C@@H]2C[C@@H](CN2C(=O)c2ccccc2)NC(=O)[C@H](Cc2cccc(C(F)(F)F)c2)NC(=O)[C@@H](C(C)C)CNC(=O)CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O
|
C62H71F3N14O10 1229.332000 |
ZAPBZKBLKRCOOA-DZWHKMBNSA-N | O15151, Q00987 | Protein Mdm4, E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50617216; PubChem:CID171378349
|
Local ready
Direct docking supported
|