| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L065081
BDB065081
|
BDBM50646530
COc1ncnc(C2CC2)c1-c1ncc2ccc(=O)n(C(C)c3ccc(-c4nc(C(F)(F)F)cn4C(C)C)cc3)c2n1
|
C30H28F3N7O2 575.595000 |
AUSSDHANKWMPME-UHFFFAOYSA-N | Q8TAF3 | WD repeat-containing protein 48 |
BindingDB, PubChem
BindingDB:BDBM50646530; PubChem:CID177377992
|
Local ready
Direct docking supported
|
|
E3L065082
BDB065082
|
BDBM50646618
Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)COCCCCCn2cc(COc3ccc(COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C[C@@H]4CCNC4=O)C(O)S(=O)(=O)O)cc3)nn2)C(C)(C)C)cc1
|
C53H74N10O14S2 1139.365000 |
RZGWXIMFXSAXRM-IZNUDPBISA-N | Q15369 | Elongin-C |
BindingDB
BindingDB:BDBM50646618
|
Local ready
Direct docking supported
|
|
E3L065083
BDB065083
|
BDBM50646619
Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)COCCCCCn2cc(COc3ccc(COC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C=O)C[C@@H]4CCNC4=O)cc3)nn2)C(C)(C)C)cc1
|
C53H72N10O11S 1057.285000 |
JPWOPFCHHBSUKB-UBCBJBLPSA-N | Q15369 | Elongin-C |
BindingDB
BindingDB:BDBM50646619
|
Local ready
Direct docking supported
|
|
E3L065084
BDB065084
|
BDBM50646620
Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)COCCCCCn2cc(COc3ccc(COC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CO)C[C@@H]4CCNC4=O)cc3)nn2)C(C)(C)C)cc1
|
C53H74N10O11S 1059.301000 |
YVMCSCTUGACGHQ-UBCBJBLPSA-N | Q15369 | Elongin-C |
BindingDB
BindingDB:BDBM50646620
|
Local ready
Direct docking supported
|
|
E3L065085
BDB065085
|
BDBM50646621
Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](N)C(C)(C)C)cc1
|
C22H30N4O3S 430.574000 |
ZLOXMSNKPDWMEF-ZIFCJYIRSA-N | Q15369 | Elongin-C |
BindingDB, PubChem
BindingDB:BDBM50646621; PubChem:CID89702519
|
Local ready
Direct docking supported
|
|
E3L065086
BDB065086
|
BDBM50646696
COc1cc2c(NC3CCN(C(C)C)CC3)nc(C#N)nc2cc1OCCCN1CCCC1
|
C25H36N6O2 452.603000 |
KKXRBRPMTQSNTJ-UHFFFAOYSA-N | O96028, Q03164 | Histone-lysine N-methyltransferase 2A, Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50646696; PubChem:CID163713000
|
Local ready
Direct docking supported
|
|
E3L065087
BDB065087
|
BDBM50646697
COc1cc2c(NC3CCN(C)CC3)nc(C#N)nc2cc1OCCCN1CCCC1
|
C23H32N6O2 424.549000 |
YYXVQDZRELJUBX-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50646697; PubChem:CID177378118
|
Local ready
Direct docking supported
|
|
E3L065088
BDB065088
|
BDBM50646698
CCCN1CCC(Nc2nc(C#N)nc3cc(OCCCN4CCCC4)c(OC)cc23)CC1
|
C25H36N6O2 452.603000 |
RWIWOWGXKHFTHM-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50646698; PubChem:CID172220423
|
Local ready
Direct docking supported
|
|
E3L065089
BDB065089
|
BDBM50646699
COc1cc2c(NC3CCN(C4CC4)CC3)nc(C#N)nc2cc1OCCCN1CCCC1
|
C25H34N6O2 450.587000 |
MBUONUPUCSDIFQ-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50646699; PubChem:CID172220411
|
Local ready
Direct docking supported
|
|
E3L065090
BDB065090
|
BDBM50646700
COc1cc2c(NC3CCN(C4CCCCC4)CC3)nc(C#N)nc2cc1OCCCN1CCCC1
|
C28H40N6O2 492.668000 |
MPYDHWGOMXNQOW-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50646700; PubChem:CID177378119
|
Local ready
Direct docking supported
|
|
E3L065091
BDB065091
|
BDBM50646701
COc1cc2c(NC3CCN(Cc4ccccc4)CC3)nc(C#N)nc2cc1OCCCN1CCCC1
|
C29H36N6O2 500.647000 |
CGAGSHBMXYRDJN-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50646701; PubChem:CID177378120
|
Local ready
Direct docking supported
|
|
E3L065092
BDB065092
|
BDBM50646702
COc1cc2c(NCC3CCN(C)CC3)nc(C#N)nc2cc1OCCCN1CCCC1
|
C24H34N6O2 438.576000 |
BYCFGRRIIUNHIZ-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50646702; PubChem:CID177378121
|
Local ready
Direct docking supported
|
|
E3L065093
BDB065093
|
BDBM50646703
COc1cc2c(NC3CCN(C(C)C)CC3)nc(C#N)nc2cc1OCCCN1CCCCC1
|
C26H38N6O2 466.630000 |
NEJODHSPAWSHOK-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50646703; PubChem:CID177378122
|
Local ready
Direct docking supported
|
|
E3L065094
BDB065094
|
BDBM50646704
COc1cc2c(NC3CCN(C(C)C)CC3)nc(C#N)nc2cc1OCCCN(C)C
|
C23H34N6O2 426.565000 |
XUMFFNYIUQTNKW-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50646704; PubChem:CID177378123
|
Local ready
Direct docking supported
|
|
E3L065095
BDB065095
|
BDBM50646705
COc1cc2nc(C#N)nc(NC3CCN(Cc4ccccc4)CC3)c2cc1OC
|
C23H25N5O2 403.486000 |
RQLBXYOKZOJWHL-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50646705; PubChem:CID177378124
|
Local ready
Direct docking supported
|
|
E3L065096
BDB065096
|
BDBM50646706
COc1cc2nc(C#N)nc(NC3CCN(C(C)C)CC3)c2cc1OC
|
C19H25N5O2 355.442000 |
YZCVYKLALYEZAY-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50646706; PubChem:CID172220412
|
Local ready
Direct docking supported
|
|
E3L065097
BDB065097
|
BDBM50646707
COc1cc2c(NC3CCN(C(C)C)CC3)nc(C#N)nc2cc1OCCCN1CCOCC1
|
C25H36N6O3 468.602000 |
CFMYKRWFDVCYRR-UHFFFAOYSA-N | O96028, Q03164 | Histone-lysine N-methyltransferase NSD2, Histone-lysine N-methyltransferase 2A |
BindingDB, PubChem
BindingDB:BDBM50646707; PubChem:CID172220408
|
Local ready
Direct docking supported
|
|
E3L065098
BDB065098
|
BDBM50646708
COc1cc2c(NC3CCN(C)CC3)cc(C#N)nc2cc1OCCCN1CCCC1
|
C24H33N5O2 423.561000 |
DCCAQKTZHJSEKP-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50646708; PubChem:CID177378125
|
Local ready
Direct docking supported
|
|
E3L065099
BDB065099
|
BDBM50646709
CCCN1CCC(Nc2cc(C#N)nc3cc(OCCCN4CCCC4)c(OC)cc23)CC1
|
C26H37N5O2 451.615000 |
VDFCTSUFEJCENU-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50646709; PubChem:CID177378126
|
Local ready
Direct docking supported
|
|
E3L065100
BDB065100
|
BDBM50646710
COc1cc2c(NC3CCN(C(C)C)CC3)cc(C#N)nc2cc1OCCCN1CCCC1
|
C26H37N5O2 451.615000 |
ABOYMKZJGPBYCR-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50646710; PubChem:CID172220427
|
Local ready
Direct docking supported
|