| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L027201
BDB027201
|
US11420970, Example 16
COc1ccc(-c2cc(Cn3cnc4c(N)ncnc43)c(N3C[C@H](N)CC(F)(F)C3)cn2)cc1F
|
C23H23F3N8O 484.486000 |
NUGJXEFLHUSBBU-OAHLLOKOSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567815; PubChem:CID156073291
|
Local ready
Direct docking supported
|
|
E3L027202
BDB027202
|
US11420970, Example 17
Nc1ncnc2c1ncn2Cc1cc(-c2cccc(F)c2)ncc1N1CCC(F)(F)C(N)C1
|
C22H21F3N8 454.460000 |
KJVWJAOMLPDQCX-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567816; PubChem:CID156073292
|
Local ready
Direct docking supported
|
|
E3L027203
BDB027203
|
US11420970, Example 18
N#CC1CCN(c2cnc(-c3ccc(F)c(F)c3)cc2Cn2cnc3c(N)ncnc32)CC1N
|
C23H21F2N9 461.480000 |
SFTMCBNTGUJKSK-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567817; PubChem:CID156073296
|
Local ready
Direct docking supported
|
|
E3L027204
BDB027204
|
US11420970, Example 19
COc1ccc(-c2cc(Cn3cnc4c(N)ncc(Cl)c43)c(N3CCC[C@@H](N)C3)cn2)cc1F
|
C24H25ClFN7O 481.963000 |
KKGDABGBVJHUKL-MRXNPFEDSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567818; PubChem:CID156073295
|
Local ready
Direct docking supported
|
|
E3L027205
BDB027205
|
US11420970, Example 20
COc1ccc(-c2cc(Cn3cnc4c(N)ncnc43)c(N3CCC[C@@](C)(N)C3)cn2)cc1F
|
C24H27FN8O 462.533000 |
GYWOYWWKVOFNII-XMMPIXPASA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567819; PubChem:CID156073297
|
Local ready
Direct docking supported
|
|
E3L027206
BDB027206
|
US11420970, Example 21
COc1ccc(-c2cc(Cn3cnc4c(N)nccc43)c(N3CCC[C@@H](N)C3)cn2)cc1F
|
C24H26FN7O 447.518000 |
BNFGPUKRKDNHAD-QGZVFWFLSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567820; PubChem:CID156073244
|
Local ready
Direct docking supported
|
|
E3L027207
BDB027207
|
US11420970, Example 22
CC(C)(C)OC(=O)NC1(COC2CC2)CCCC(c2cnc(-c3ccc(F)c(F)c3)cc2Cn2cnc3c(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)ncnc32)C1
|
C42H53F2N7O7 805.924000 |
TTWUHYDPCXBQBA-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567821; PubChem:CID164850541
|
Local ready
Direct docking supported
|
|
E3L027208
BDB027208
|
US11420970, Example 23
COC[C@@]1(N)CCCN(c2cnc(-c3ccc(F)c(F)c3)cc2Cn2cnc3c(N)ncnc32)C1
|
C24H26F2N8O 480.523000 |
OPJPZRUHVUFNAY-XMMPIXPASA-N | O96028, Q96L73, Q9BZ95 | Histone-lysine N-methyltransferase, H3 lysine-36 specific, Histone-lysine N-methyltransferase NSD3, Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567822; PubChem:CID156073366
|
Local ready
Direct docking supported
|
|
E3L027209
BDB027209
|
US11420970, Example 24
COC[C@@]1(N)CCCN(c2cnc(-c3cccc(F)c3)cc2Cn2cnc3c(N)ncnc32)C1
|
C24H27FN8O 462.533000 |
ONDDZQBUDLRTPM-XMMPIXPASA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567823; PubChem:CID156073370
|
Local ready
Direct docking supported
|
|
E3L027210
BDB027210
|
US11420970, Example 25
COc1ccc(-c2cc(Cn3cnc4c(N)ncnc43)c(N3CCC[C@](N)(COC(C)C)C3)cn2)cc1F
|
C27H33FN8O2 520.613000 |
VCCJVEMOXLGIOU-HHHXNRCGSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567824; PubChem:CID156073371
|
Local ready
Direct docking supported
|
|
E3L027211
BDB027211
|
US11420970, Example 26
COC[C@@]1(N)CCCN(c2cnc(-c3cc(Cl)ccc3F)cc2Cn2cnc3c(N)ncnc32)C1
|
C24H26ClFN8O 496.978000 |
FUEGZWGKKBGDBO-XMMPIXPASA-N | O96028, Q96L73, Q9BZ95 | Histone-lysine N-methyltransferase NSD3, Histone-lysine N-methyltransferase, H3 lysine-36 specific, Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567825; PubChem:CID156073369
|
Local ready
Direct docking supported
|
|
E3L027212
BDB027212
|
US11420970, Example 27
COC[C@@]1(N)CCCN(c2cnc(-c3cccc(Cl)c3)cc2Cn2cnc3c(N)ncnc32)C1
|
C24H27ClN8O 478.988000 |
KTUHWZKSTCXWJK-XMMPIXPASA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567826; PubChem:CID156073301
|
Local ready
Direct docking supported
|
|
E3L027213
BDB027213
|
US11420970, Example 28
COC[C@@]1(N)CCCN(c2cnc(-c3ccc(F)c(Cl)c3)cc2Cn2cnc3c(N)ncnc32)C1
|
C24H26ClFN8O 496.978000 |
UKOSZBQLKHMNOY-XMMPIXPASA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567827; PubChem:CID156073302
|
Local ready
Direct docking supported
|
|
E3L027214
BDB027214
|
US11420970, Example 29
COC[C@@]1(N)CCCN(c2cnc(-c3ccc(F)cc3F)cc2Cn2cnc3c(N)ncnc32)C1
|
C24H26F2N8O 480.523000 |
DGGOQICQTAGRMC-XMMPIXPASA-N | O96028, Q96L73, Q9BZ95 | Histone-lysine N-methyltransferase NSD2, Histone-lysine N-methyltransferase NSD3, Histone-lysine N-methyltransferase, H3 lysine-36 specific |
BindingDB, PubChem
BindingDB:BDBM567828; PubChem:CID156073304
|
Local ready
Direct docking supported
|
|
E3L027215
BDB027215
|
US11420970, Example 30
Nc1ncnc2c1ncn2Cc1cc(-c2ccc(F)c(F)c2)ncc1N1CCC[C@](N)(COC2CCC2)C1
|
C27H30F2N8O 520.588000 |
JVKDBWFAAAXKFO-HHHXNRCGSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567829; PubChem:CID156073303
|
Local ready
Direct docking supported
|
|
E3L027216
BDB027216
|
US11420970, Example 31
COc1ccc(-c2cc(Cn3cnc4c(N)ncnc43)c(N3CCC[C@](N)(COC4CC4)C3)cn2)cc1F
|
C27H31FN8O2 518.597000 |
GPTYHWNTLKIMDK-HHHXNRCGSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567830; PubChem:CID156073305
|
Local ready
Direct docking supported
|
|
E3L027217
BDB027217
|
US11420970, Example 32
COc1ccc(-c2cc(Cn3cnc4c(N)ncnc43)c(N3CCC[C@](N)(COC4CCC4)C3)cn2)cc1F
|
C28H33FN8O2 532.624000 |
WLGCCCLQJAMXCP-MUUNZHRXSA-N | O96028, Q96L73, Q9BZ95 | Histone-lysine N-methyltransferase NSD3, Histone-lysine N-methyltransferase NSD2, Histone-lysine N-methyltransferase, H3 lysine-36 specific |
BindingDB, PubChem
BindingDB:BDBM567831; PubChem:CID156073361
|
Local ready
Direct docking supported
|
|
E3L027218
BDB027218
|
US11420970, Example 33
COC[C@@]1(N)CCCN(c2cnc(-c3ccc(OC)cc3F)cc2Cn2cnc3c(N)ncnc32)C1
|
C25H29FN8O2 492.559000 |
AOJRLTYJVMCYOE-RUZDIDTESA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567832; PubChem:CID156073357
|
Local ready
Direct docking supported
|
|
E3L027219
BDB027219
|
US11420970, Example 34
CC(C)OC[C@@]1(N)CCCN(c2cnc(-c3ccc(F)c(F)c3)cc2Cn2cnc3c(N)ncnc32)C1
|
C26H30F2N8O 508.577000 |
SOJLHSBCIADIJS-AREMUKBSSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567833; PubChem:CID156073359
|
Local ready
Direct docking supported
|
|
E3L027220
BDB027220
|
US11420970, Example 35
Nc1ncnc2c1ncn2Cc1cc(-c2cccc(F)c2)ncc1N1CCC[C@](N)(COC2CCC2)C1
|
C27H31FN8O 502.598000 |
NCRSKTPDDDOMPR-HHHXNRCGSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM567834; PubChem:CID156073358
|
Local ready
Direct docking supported
|