| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L029721
BDB029721
|
US11623929, Example 10
COC(=O)c1ccc(N2CCC3(CC(=O)NC3=O)C2)nc1
|
C14H15N3O4 289.291000 |
GYDGGFJIHASCKP-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM600508; PubChem:CID150373133
|
Local ready
Direct docking supported
|
|
E3L029722
BDB029722
|
US11623929, Example 11
O=C1CC2(CCN(c3nc4ccccc4s3)C2)C(=O)N1
|
C14H13N3O2S 287.344000 |
UDRDPSVGVXICRB-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM600509; PubChem:CID151986076
|
Local ready
Direct docking supported
|
|
E3L029723
BDB029723
|
US11623929, Example 12
O=C1CC2(CCN(C(=O)c3cnn4ccccc34)C2)C(=O)N1
|
C15H14N4O3 298.302000 |
WDZJVWSRFXJQFY-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM600510; PubChem:CID152244271
|
Local ready
Direct docking supported
|
|
E3L029724
BDB029724
|
7-Benzoyl-2,7-diazaspiro[4.4]nonane-1,3-dione
O=C1CC2(CCN(C(=O)c3ccccc3)C2)C(=O)N1
|
C14H14N2O3 258.277000 |
RQGVCBYHXMUZAF-UHFFFAOYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM600511; PubChem:CID146764559
|
Local ready
Direct docking supported
|
|
E3L029725
BDB029725
|
US11623929, Example 14
O=C1C[C@@]2(CCN(C(=O)c3ccc4scnc4c3)C2)C(=O)N1
|
C15H13N3O3S 315.354000 |
DMMCKRVBNHWAOD-OAHLLOKOSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM600512; PubChem:CID156142598
|
Local ready
Direct docking supported
|
|
E3L029726
BDB029726
|
US11623929, Example 15
O=C1C[C@]2(CCN(C(=O)c3ccc4scnc4c3)C2)C(=O)N1
|
C15H13N3O3S 315.354000 |
DMMCKRVBNHWAOD-HNNXBMFYSA-N | Q16531, Q96SW2 | DNA damage-binding protein 1 |
BindingDB, PubChem
BindingDB:BDBM600513; PubChem:CID156142291
|
Local ready
Direct docking supported
|
|
E3L029727
BDB029727
|
US11639355, Example 1-I
COc1ncc(-c2nc3c(n2C(C)C)[C@H](c2ccc(Cl)cc2)N(c2ccc4c(c2)OCO4)C3=O)c(OC)n1
|
C27H24ClN5O5 533.972000 |
SRELFASBIUSRRN-QFIPXVFZSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM601679; PubChem:CID139500065
|
Local ready
Direct docking supported
|
|
E3L029728
BDB029728
|
US11639355, Example 2
COc1ncc(-c2nc3c(n2C(C)C)C(c2ccc(Cl)cc2)N(c2ccc4scnc4c2)C3=O)c(OC)n1
|
C27H23ClN6O3S 547.040000 |
NOPPDKGKHIJYAR-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM601680; PubChem:CID139500207
|
Local ready
Direct docking supported
|
|
E3L029729
BDB029729
|
US11639355, Example 3
COc1ncc(-c2nc3c(n2C(C)C)C(c2ccc(Cl)cc2)N(c2ccc4ncsc4c2)C3=O)c(OC)n1
|
C27H23ClN6O3S 547.040000 |
BNWSNWAGNJWLLP-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM601681; PubChem:CID139500197
|
Local ready
Direct docking supported
|
|
E3L029730
BDB029730
|
US11639355, Example 4
COc1ncc(-c2nc3c(n2C(C)C)C(c2ccc(Cl)cc2)N(c2ccc4c(c2)OC(F)(F)O4)C3=O)c(OC)n1
|
C27H22ClF2N5O5 569.952000 |
RVZYZGJENVZMRY-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM601682; PubChem:CID139500211
|
Local ready
Direct docking supported
|
|
E3L029731
BDB029731
|
US11639355, Example 5
COc1ncc(-c2nc3c(n2C(C)C)C(c2ccc(Cl)cc2)N(c2cc(F)c4c(c2)OCO4)C3=O)c(OC)n1
|
C27H23ClFN5O5 551.962000 |
AUYPDCJTVVOMAL-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM601683; PubChem:CID139500212
|
Local ready
Direct docking supported
|
|
E3L029732
BDB029732
|
US11639355, Example 7-II
COc1ncc(-c2nc3c(n2C(C)C)[C@@](C)(c2ccc(Cl)cc2)N(c2ccc4c(c2)OCO4)C3=O)c(OC)n1
|
C28H26ClN5O5 547.999000 |
VHZNEKDCJYXJMC-MUUNZHRXSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM601684; PubChem:CID139500080
|
Local ready
Direct docking supported
|
|
E3L029733
BDB029733
|
US11639355, Example 8-I
COc1ncc(-c2nc3c(n2C(C)C)[C@H](c2ccc(Cl)s2)N(c2ccc4c(c2)OCO4)C3=O)c(OC)n1
|
C25H22ClN5O5S 540.001000 |
WMJFWZADPVSDPM-FQEVSTJZSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM601685; PubChem:CID139500181
|
Local ready
Direct docking supported
|
|
E3L029734
BDB029734
|
US11639355, Example 9I
COc1ncc(-c2nc3c(n2C(C)C)[C@H](c2ccc(Cl)s2)N(c2cc4c(cc2F)OCO4)C3=O)c(OC)n1
|
C25H21ClFN5O5S 557.991000 |
XCSIMLPZVYFALB-FQEVSTJZSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM601686; PubChem:CID139500182
|
Local ready
Direct docking supported
|
|
E3L029735
BDB029735
|
US11639355, Example 10-I
COc1ncc(-c2nc3c(n2C(C)C)[C@@H](c2ccc(Cl)s2)N(c2cc4c(cc2Cl)OCO4)C3=O)c(OC)n1
|
C25H21Cl2N5O5S 574.446000 |
JZYMOIFOKLJNGS-HXUWFJFHSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM601687; PubChem:CID139500083
|
Local ready
Direct docking supported
|
|
E3L029736
BDB029736
|
US11639355, Example 11-I
COc1ncc(-c2nc3c(n2C(C)C)[C@H](c2ccc(Cl)cc2)N(c2cc(Cl)c4c(c2)OCO4)C3=O)c(OC)n1
|
C27H23Cl2N5O5 568.417000 |
HGDOAGYSQBILFW-NRFANRHFSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM601690; PubChem:CID139500190
|
Local ready
Direct docking supported
|
|
E3L029737
BDB029737
|
US11639355, Example 12-I
COc1ncc(-c2nc3c(n2C(C)C)[C@H](c2ccc(Cl)cc2)N(c2cc(C)c4c(c2)OCO4)C3=O)c(OC)n1
|
C28H26ClN5O5 547.999000 |
ACLLXTVQPKMSMX-QFIPXVFZSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM601692; PubChem:CID139500063
|
Local ready
Direct docking supported
|
|
E3L029738
BDB029738
|
US11639355, Example 13-I
COc1ncc(-c2nc3c(n2C(C)C)[C@@H](c2ccc(Cl)cc2)N(c2cc(Cl)cn4cnnc24)C3=O)c(OC)n1
|
C26H22Cl2N8O3 565.421000 |
XREDYCIWZNCVFG-HXUWFJFHSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM601693; PubChem:CID139500078
|
Local ready
Direct docking supported
|
|
E3L029739
BDB029739
|
US11639355, Example 14-II
COc1ncc(-c2nc3c(n2C(C)C)[C@@H](c2ccc(Cl)cc2)N(c2cc(Cl)cn4ccnc24)C3=O)c(OC)n1
|
C27H23Cl2N7O3 564.433000 |
FDDSITCTOGNKTQ-OAQYLSRUSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM601694; PubChem:CID139500084
|
Local ready
Direct docking supported
|
|
E3L029740
BDB029740
|
US11639355, Example 15
COc1ncc(-c2nc3c(n2C(C)C)C(c2ccc(Cl)cc2)N(c2cc(Cl)cc4[nH]ncc24)C3=O)c(OC)n1
|
C27H23Cl2N7O3 564.433000 |
PUZLQFUMPKIPOQ-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM601695; PubChem:CID139500060
|
Local ready
Direct docking supported
|