| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L064441
BDB064441
|
BDBM50633124
Cc1cc(O)c(C(=O)/C=C/c2ccncc2)c(=O)o1
|
C14H11NO4 257.245000 |
ZSBPEMYSEGRXDP-NSCUHMNNSA-N | P37231 | Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM50633124; PubChem:CID135548564
|
Local ready
Direct docking supported
|
|
E3L064442
BDB064442
|
BDBM50633488
CC(C)CN[C@@H](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
|
C19H31N7O5 437.501000 |
JFKLCPCUECHESR-AEFKHOGKSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50633488; PubChem:CID172471547
|
Local ready
Direct docking supported
|
|
E3L064443
BDB064443
|
1-(3-Methylbenzotriazol-5-yl)-3-(3-nitrophenyl)urea
Cn1nnc2ccc(NC(=O)Nc3cccc([N+](=O)[O-])c3)cc21
|
C14H12N6O3 312.289000 |
FWNGJGFKYYRQQC-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50633489; PubChem:CID172461831
|
Local ready
Direct docking supported
|
|
E3L064444
BDB064444
|
BDBM50633490
CC(C)N(Cc1ccc(C(=O)Nc2ccncn2)cc1)C(=O)c1ccc2c(c1)OCC(=O)N2
|
C24H23N5O4 445.479000 |
HUIINGSTUYTZJL-UHFFFAOYSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM50633490; PubChem:CID156587156
|
Local ready
Direct docking supported
|
|
E3L064445
BDB064445
|
BDBM50633533
Cn1cc(Br)cc1C(=O)NC[C@@H]1[C@@H](CNC(=O)c2ccc(Br)[nH]2)Cc2nc(N)[nH]c2[C@H]1c1c[nH]c(N)n1
|
C23H26Br2N10O2 634.337000 |
NXOHZQPKOIIHJL-AJLCLMPTSA-N | Q13191 | E3 ubiquitin-protein ligase CBL-B |
BindingDB
BindingDB:BDBM50633533
|
Local ready
Direct docking supported
|
|
E3L064446
BDB064446
|
BDBM50634522
c1ccc2cc(-c3nn[nH]n3)c(NCC3CCNCC3)cc2c1
|
C17H20N6 308.389000 |
LMIATWSHEGFRKL-UHFFFAOYSA-N | Q8NG06 | E3 ubiquitin-protein ligase TRIM58 |
BindingDB, PubChem
BindingDB:BDBM50634522; PubChem:CID172438937
|
Local ready
Direct docking supported
|
|
E3L064447
BDB064447
|
BDBM50634523
CNc1nc(NCC2CCNCC2)c2cc(-c3ccccc3)ccc2n1
|
C21H25N5 347.466000 |
YLVYCXZZAVEBSL-UHFFFAOYSA-N | Q8NG06 | E3 ubiquitin-protein ligase TRIM58 |
BindingDB, PubChem
BindingDB:BDBM50634523; PubChem:CID172452048
|
Local ready
Direct docking supported
|
|
E3L064448
BDB064448
|
BDBM50634524
c1ccc(-c2ccc3nc(NCC4CC4)nc(NCC4CCNCC4)c3c2)cc1
|
C24H29N5 387.531000 |
ZTPRSFGGSCDKOB-UHFFFAOYSA-N | Q8NG06 | E3 ubiquitin-protein ligase TRIM58 |
BindingDB, PubChem
BindingDB:BDBM50634524; PubChem:CID172458447
|
Local ready
Direct docking supported
|
|
E3L064449
BDB064449
|
BDBM50634525
CNCCCNc1nc(NCC2CCNCC2)c2cc(-c3ccccc3)ccc2n1
|
C24H32N6 404.562000 |
VZXFRRQNTDJGNI-UHFFFAOYSA-N | Q8NG06 | E3 ubiquitin-protein ligase TRIM58 |
BindingDB, PubChem
BindingDB:BDBM50634525; PubChem:CID172454689
|
Local ready
Direct docking supported
|
|
E3L064450
BDB064450
|
BDBM50634526
CNc1nc(OCC2CCNCC2)c2cc(-c3ccccc3)ccc2n1
|
C21H24N4O 348.450000 |
UTRFNWVSSIAVOX-UHFFFAOYSA-N | Q8NG06 | E3 ubiquitin-protein ligase TRIM58 |
BindingDB, PubChem
BindingDB:BDBM50634526; PubChem:CID172464053
|
Local ready
Direct docking supported
|
|
E3L064451
BDB064451
|
2-N,4-N-dimethyl-6-phenylquinazoline-2,4-diamine
CNc1nc(NC)c2cc(-c3ccccc3)ccc2n1
|
C16H16N4 264.332000 |
MCQRYXXEPKXUGS-UHFFFAOYSA-N | Q8NG06 | E3 ubiquitin-protein ligase TRIM58 |
BindingDB, PubChem
BindingDB:BDBM50634527; PubChem:CID172448322
|
Local ready
Direct docking supported
|
|
E3L064452
BDB064452
|
BDBM50634528
CCCCCCNc1nc(NCCCN(C)C)nc2ccc(-c3ccccc3)cc12
|
C25H35N5 405.590000 |
NGYDGLMAQQRJTK-UHFFFAOYSA-N | Q8NG06 | E3 ubiquitin-protein ligase TRIM58 |
BindingDB, PubChem
BindingDB:BDBM50634528; PubChem:CID172467568
|
Local ready
Direct docking supported
|
|
E3L064453
BDB064453
|
BDBM50634529
CN(C)CCCNc1nc(NCCc2ccccc2)c2cc(-c3ccccc3)ccc2n1
|
C27H31N5 425.580000 |
UJMCTWBKQPRWTJ-UHFFFAOYSA-N | Q8NG06 | E3 ubiquitin-protein ligase TRIM58 |
BindingDB, PubChem
BindingDB:BDBM50634529; PubChem:CID172458189
|
Local ready
Direct docking supported
|
|
E3L064454
BDB064454
|
BDBM50634530
CNc1nc(NCC2CCNCC2)c2ccccc2n1
|
C15H21N5 271.368000 |
ZYOAIFZNTHSVAR-UHFFFAOYSA-N | Q8NG06 | E3 ubiquitin-protein ligase TRIM58 |
BindingDB, PubChem
BindingDB:BDBM50634530; PubChem:CID172460241
|
Local ready
Direct docking supported
|
|
E3L064455
BDB064455
|
BDBM50634531
CNc1nc(NCC2CCNCC2)c2cc(C3CCCCC3)ccc2n1
|
C21H31N5 353.514000 |
UWOTVDZAKNTYGN-UHFFFAOYSA-N | Q8NG06 | E3 ubiquitin-protein ligase TRIM58 |
BindingDB, PubChem
BindingDB:BDBM50634531; PubChem:CID172455446
|
Local ready
Direct docking supported
|
|
E3L064456
BDB064456
|
BDBM50634532
CN(C)CCCNc1nc(NCC2CCNCC2)c2cc(-c3ccccc3)ccc2n1
|
C25H34N6 418.589000 |
ZQESDCZQQXAWMA-UHFFFAOYSA-N | Q8NG06 | E3 ubiquitin-protein ligase TRIM58 |
BindingDB, PubChem
BindingDB:BDBM50634532; PubChem:CID170452578
|
Local ready
Direct docking supported
|
|
E3L064457
BDB064457
|
Cbl-b-IN-15
C[C@H]1CN(Cc2ccccc2C(=O)N[C@H]2N=C(c3ccccc3)c3ccncc3NC2=O)CCO1
|
C27H27N5O3 469.545000 |
JNGHRJXDWKEWQM-AVRWGWEMSA-N | Q13191 | E3 ubiquitin-protein ligase CBL-B |
BindingDB, PubChem
BindingDB:BDBM50634563; PubChem:CID169410443
|
Local ready
Direct docking supported
|
|
E3L064458
BDB064458
|
BDBM50634564
O=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccccc1CN1CCOCC1
|
C27H26N4O3 454.530000 |
NBCFKFUKUXVZQS-UHFFFAOYSA-N | Q13191 | E3 ubiquitin-protein ligase CBL-B |
BindingDB, PubChem
BindingDB:BDBM50634564; PubChem:CID11496191
|
Local ready
Direct docking supported
|
|
E3L064459
BDB064459
|
BDBM50634565
O=C(N[C@H]1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccccc1CN1CCOCC1
|
C27H26N4O3 454.530000 |
NBCFKFUKUXVZQS-RUZDIDTESA-N | Q13191 | E3 ubiquitin-protein ligase CBL-B |
BindingDB, PubChem
BindingDB:BDBM50634565; PubChem:CID169410442
|
Local ready
Direct docking supported
|
|
E3L064460
BDB064460
|
BDBM50634566
O=C(N[C@@H]1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccccc1CN1CCOCC1
|
C27H26N4O3 454.530000 |
NBCFKFUKUXVZQS-VWLOTQADSA-N | Q13191 | E3 ubiquitin-protein ligase CBL-B |
BindingDB, PubChem
BindingDB:BDBM50634566; PubChem:CID172448573
|
Local ready
Direct docking supported
|