| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L027261
BDB027261
|
US11420970, Example 80
COc1ccc(-c2cc(Cn3cnc4c(N)ncnc43)c(N3CCC[C@](N)(C(=O)N(C)C)C3)cn2)cc1F
|
C26H30FN9O2 519.585000 |
ZDOQIKHMVSNXHC-AREMUKBSSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567879; PubChem:CID164850529
|
Local ready
Direct docking supported
|
|
E3L027262
BDB027262
|
US11420970, Example 81
COc1ccc(-c2cc(Cn3cnc4c(N)ncnc43)c(N3CCC[C@](N)(C(=O)OC(C)C)C3)cn2)cc1F
|
C27H31FN8O3 534.596000 |
MOGJMYHOGBCALY-HHHXNRCGSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567880; PubChem:CID156073376
|
Local ready
Direct docking supported
|
|
E3L027263
BDB027263
|
US11420970, Example 82
Nc1ncnc2c1ncn2Cc1cc(-c2ccc(F)c(F)c2)ncc1N1CCC[C@](N)(C(=O)NC2CCOCC2)C1
|
C28H31F2N9O2 563.613000 |
BWPOKCVRRPKLTO-MUUNZHRXSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567881; PubChem:CID156073378
|
Local ready
Direct docking supported
|
|
E3L027264
BDB027264
|
US11420970, Example 83
COc1ccc(-c2cc(Cn3cnc4c(N)ncnc43)c(N3CCC[C@](N)(C(=O)NC(C)(C)C)C3)cn2)cc1F
|
C28H34FN9O2 547.639000 |
VVCVWFZFKOXMLL-MUUNZHRXSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567882; PubChem:CID164850551
|
Local ready
Direct docking supported
|
|
E3L027265
BDB027265
|
US11420970, Example 84
Nc1ncnc2c1ncn2Cc1cc(-c2ccc(F)c(F)c2)ncc1N1CCC[C@](N)(C(=O)N2CCCC2)C1
|
C27H29F2N9O 533.587000 |
MFVAFDIMCWXZIE-HHHXNRCGSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567883; PubChem:CID156073165
|
Local ready
Direct docking supported
|
|
E3L027266
BDB027266
|
US11420970, Example 85
Nc1ncnc2c1ncn2Cc1cc(-c2ccc(F)c(F)c2)ncc1N1CCCC(N)(C(=O)NC2CCOC2)C1
|
C27H29F2N9O2 549.586000 |
CWDGKHZJFSMFBP-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567884; PubChem:CID156073163
|
Local ready
Direct docking supported
|
|
E3L027267
BDB027267
|
US11420970, Example 86
Nc1ncnc2c1ncn2Cc1cc(-c2ccc(F)c(F)c2)ncc1N1CCCC(N)(C(=O)N2CCCCC2)C1
|
C28H31F2N9O 547.614000 |
UVKFOCPUMOQOCP-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567885; PubChem:CID156073164
|
Local ready
Direct docking supported
|
|
E3L027268
BDB027268
|
US11420970, Example 87
CC1CCCCN1C(=O)C1(N)CCCN(c2cnc(-c3ccc(F)c(F)c3)cc2Cn2cnc3c(N)ncnc32)C1
|
C29H33F2N9O 561.641000 |
GJSQTKUYSJUOKI-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567886; PubChem:CID164850502
|
Local ready
Direct docking supported
|
|
E3L027269
BDB027269
|
US11420970, Example 88
CC1CCCN1C(=O)C1(N)CCCN(c2cnc(-c3ccc(F)c(F)c3)cc2Cn2cnc3c(N)ncnc32)C1
|
C28H31F2N9O 547.614000 |
NSRJMEFEJODBHY-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567887; PubChem:CID156073166
|
Local ready
Direct docking supported
|
|
E3L027270
BDB027270
|
US11420970, Example 89
CC(C)C(C)C(=O)C1(N)CCCN(c2cnc(-c3ccc(F)c(F)c3)cc2Cn2cnc3c(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)ncnc32)C1
|
C38H48F2N8O5 734.849000 |
MLIMDYZWEPBVCJ-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567888; PubChem:CID165436680
|
Local ready
Direct docking supported
|
|
E3L027271
BDB027271
|
US11420970, Example 90
COc1ccc(-c2cc(Cn3cnc4c(N)ncnc43)c(N3CCC[C@](N)([C@@H](C)O)C3)cn2)cc1F
|
C25H29FN8O2 492.559000 |
TULGIIDJPDOOLH-SGANQWHYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567889; PubChem:CID156073253
|
Local ready
Direct docking supported
|
|
E3L027272
BDB027272
|
US11420970, Example 91
Nc1ncnc2c1ncn2Cc1cc(-c2ccc(F)c(F)c2)ncc1N1CCC[C@](N)([C@H](F)c2ccccn2)C1
|
C28H26F3N9 545.573000 |
WMFKDPPDJSCEPO-LEAFIULHSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567890; PubChem:CID156073257
|
Local ready
Direct docking supported
|
|
E3L027273
BDB027273
|
US11420970, Example 92
COc1ccc(-c2cc(Cn3cnc4c(N)ncnc43)c(N3CCC[C@](N)([C@H](C)O)C3)cn2)cc1F
|
C25H29FN8O2 492.559000 |
TULGIIDJPDOOLH-ODCWNRFASA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567891; PubChem:CID156073258
|
Local ready
Direct docking supported
|
|
E3L027274
BDB027274
|
US11420970, Example 93
COc1ccc(-c2cc(Cn3cnc4c(N)ncnc43)c(N3CCC[C@](N)([C@H](C)OC)C3)cn2)cc1F
|
C26H31FN8O2 506.586000 |
HPXRTEYFJFTMLD-YHAMSUFESA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567892; PubChem:CID156073215
|
Local ready
Direct docking supported
|
|
E3L027275
BDB027275
|
US11420970, Example 94
COc1ccc(-c2cc(Cn3cnc4c(N)ncnc43)c(N3CCC[C@](N)([C@@H](C)OC)C3)cn2)cc1F
|
C26H31FN8O2 506.586000 |
HPXRTEYFJFTMLD-AKJBCIBTSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567893; PubChem:CID156073206
|
Local ready
Direct docking supported
|
|
E3L027276
BDB027276
|
US11420970, Example 95
CO[C@@H](C)[C@@]1(N)CCCN(c2cnc(-c3ccc(F)c(F)c3)cc2Cn2cnc3c(N)ncnc32)C1
|
C25H28F2N8O 494.550000 |
GSBRBMILDDIXOW-ODCWNRFASA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567894; PubChem:CID156073216
|
Local ready
Direct docking supported
|
|
E3L027277
BDB027277
|
US11420970, Example 96
CO/N=C(\C)C1(N)CCCN(c2cnc(-c3ccc(OC)c(F)c3)cc2Cn2cnc3c(N)ncnc32)C1
|
C26H30FN9O2 519.585000 |
DUUZXEUIYRTNPI-AABVJFSESA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567895; PubChem:CID156073213
|
Local ready
Direct docking supported
|
|
E3L027278
BDB027278
|
US11420970, Example 97
CO[C@H](C)[C@@]1(N)CCCN(c2cnc(-c3ccc(F)c(F)c3)cc2Cn2cnc3c(N)ncnc32)C1
|
C25H28F2N8O 494.550000 |
GSBRBMILDDIXOW-SGANQWHYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567896; PubChem:CID156073416
|
Local ready
Direct docking supported
|
|
E3L027279
BDB027279
|
US11420970, Example 98
CC(C)[C@H](O)[C@@]1(N)CCCN(c2cnc(-c3ccc(F)c(F)c3)cc2Cn2cnc3c(N)ncnc32)C1
|
C26H30F2N8O 508.577000 |
YPRBNFUBIQXUAL-JYFHCDHNSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567897; PubChem:CID156073412
|
Local ready
Direct docking supported
|
|
E3L027280
BDB027280
|
US11420970, Example 99
CCO[C@H](C)C1(N)CCCN(c2cnc(-c3ccc(F)c(F)c3)cc2Cn2cnc3c(N)ncnc32)C1
|
C26H30F2N8O 508.577000 |
RLHGZUOBFZEMOL-DIERRCTGSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567898; PubChem:CID156073413
|
Local ready
Direct docking supported
|