| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L001401
BDB001401
|
Isoindolinone scaffold, 64
CCCN1C(=O)c2ccccc2C1(OCc1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1)c1ccc(OCOCC[Si](C)(C)C)cc1
|
C31H37N3O8Si 607.736000 |
JFQSWXHKGFHDGF-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31269; PubChem:CID44176167
|
Local ready
Direct docking supported
|
|
E3L001402
BDB001402
|
Isoindolinone scaffold, 65
CC(=O)NCCN1C(=O)c2ccccc2C1(OCc1ccc(C(C)(C)C)cc1)c1ccccc1
|
C29H32N2O3 456.586000 |
BTICYABAFSUXAA-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31270; PubChem:CID16090412
|
Local ready
Direct docking supported
|
|
E3L001403
BDB001403
|
Isoindolinone scaffold, 67
C=C(C)C(=O)OCCN1C(=O)c2ccccc2C1(N[C@@H](CO)[C@@H](O)c1ccccc1)c1ccccc1
|
C29H30N2O5 486.568000 |
WXRBVJFGGFIGTQ-QEGCZXFXSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31271; PubChem:CID44176168
|
Local ready
Direct docking supported
|
|
E3L001404
BDB001404
|
BDBM31272
c1ccc(C(N=Nc2nc3ccccc3s2)c2ccccn2)cc1
|
C19H14N4S 330.416000 |
XYTANBRTRZCNAC-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31272; PubChem:CID91896126
|
Local ready
Direct docking supported
|
|
E3L001405
BDB001405
|
Chalcone derivative, A
O=C(O)COc1ccc(/C=C/C(=O)c2ccc(Cl)cc2)cc1
|
C17H13ClO4 316.740000 |
UFSLJQCZRHNOAH-XCVCLJGOSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31273; PubChem:CID5988917
|
Local ready
Direct docking supported
|
|
E3L001406
BDB001406
|
BDBM31274
O=C(O)COc1ccc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2)cc1
|
C17H12Cl2O4 351.185000 |
HYBWERCTQJOGFB-FPYGCLRLSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31274; PubChem:CID8856777
|
Local ready
Direct docking supported
|
|
E3L001407
BDB001407
|
BDBM31275
O=C(O)COc1ccc(C(=O)/C=C/c2ccc(Cl)c(Cl)c2)cc1
|
C17H12Cl2O4 351.185000 |
DCUDBWMZJBOZAB-KRXBUXKQSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31275; PubChem:CID7067864
|
Local ready
Direct docking supported
|
|
E3L001408
BDB001408
|
Chalcone derivative, C
CC(C)(Oc1ccc(/C=C/C(=O)c2ccc(Cl)cc2)cc1)C(=O)O
|
C19H17ClO4 344.794000 |
AICGQCAOHPDKQH-LFYBBSHMSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31276; PubChem:CID14126638
|
Local ready
Direct docking supported
|
|
E3L001409
BDB001409
|
2-Benzyl-2,3-dihydro-1H-naphtho(1,2-e)(1,3)oxazin-9-ol
Oc1ccc2ccc3c(c2c1)CN(Cc1ccccc1)CO3
|
C19H17NO2 291.350000 |
CLOONOJPKIVAIE-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31277; PubChem:CID259166
|
Local ready
Direct docking supported
|
|
E3L001410
BDB001410
|
Chalcone derivative, E
CCOC(=O)C(C)(C)Oc1ccc(CCNC(=O)/C=C/C(=O)c2ccc(Cl)cc2)cc1
|
C24H26ClNO5 443.927000 |
PSLJGGRDWMUPLT-BUHFOSPRSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31278; PubChem:CID17783233
|
Local ready
Direct docking supported
|
|
E3L001411
BDB001411
|
Chalcone derivative, F
O=C(CC(=Nc1ccccc1)c1ccccc1)Nc1ccccc1
|
C21H18N2O 314.388000 |
ZJGCTZFATLFZFS-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31279; PubChem:CID12871998
|
Local ready
Direct docking supported
|
|
E3L001412
BDB001412
|
Chalcone derivative, G
CCOc1ccc(NC(=O)CC(=Nc2ccccc2)c2ccccc2)cc1
|
C23H22N2O2 358.441000 |
WHAMZFYDMJTIKX-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31280; PubChem:CID44176169
|
Local ready
Direct docking supported
|
|
E3L001413
BDB001413
|
Chalcone derivative, H
O=C(C(=S)Nc1ccccc1)C(C=Nc1ccccc1)c1ccccc1
|
C22H18N2OS 358.466000 |
WSOXYTIBSUTHGB-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31281; PubChem:CID91896127
|
Local ready
Direct docking supported
|
|
E3L001414
BDB001414
|
Chalcone derivative, L
CCC(C)Cc1ccc(OCC(=O)O)c(Cl)c1Cl
|
C13H16Cl2O3 291.174000 |
PCRBZOCSBMHOTP-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31282; PubChem:CID44176171
|
Local ready
Direct docking supported
|
|
E3L001415
BDB001415
|
BDBM31283
O=C(O)COc1c(Br)cc(/C=C/C(=O)c2ccc3ccccc3c2)cc1Br
|
C21H14Br2O4 490.147000 |
MBAPQUAKCNYSCD-VMPITWQZSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31283; PubChem:CID5709454
|
Local ready
Direct docking supported
|
|
E3L001416
BDB001416
|
BDBM31284
CC(C)Oc1ccc(C(=O)NS(=O)(=O)c2ccc(N=Nc3c(O)n(-c4ccccc4)n(-c4ccccc4)c3=O)cc2)cc1
|
C31H27N5O6S 597.653000 |
ZJITYUYLFDQEPQ-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31284; PubChem:CID322340
|
Local ready
Direct docking supported
|
|
E3L001417
BDB001417
|
BDBM31285
O=C(O)[C@H](c1ccc(Cl)cc1)N1C(=O)c2cc(I)ccc2NC(=O)[C@@H]1c1ccc(Cl)cc1
|
C23H15Cl2IN2O4 581.193000 |
HQEQUYKKMMKSSX-PMACEKPBSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31285; PubChem:CID656933
|
Local ready
Direct docking supported
|
|
E3L001418
BDB001418
|
Benzodiazepinedione, 2
O=C(O)[C@@H](c1ccc(Cl)cc1)N1C(=O)c2cc(I)ccc2NC(=O)[C@H]1c1ccc(Cl)cc1
|
C23H15Cl2IN2O4 581.193000 |
HQEQUYKKMMKSSX-WOJBJXKFSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31286; PubChem:CID11250180
|
Local ready
Direct docking supported
|
|
E3L001419
BDB001419
|
1,4-Benzodiazepine-2,5-dione scaffold, 52
Nc1cc(Cl)ccc1CN1C(=O)c2cc(I)ccc2N(CCCCC(=O)O)C(=O)[C@@H]1c1ccc(Cl)cc1
|
C27H24Cl2IN3O4 652.316000 |
GTYWDSONJKDRTC-VWLOTQADSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31287; PubChem:CID44176172
|
Local ready
Direct docking supported
|
|
E3L001420
BDB001420
|
1,4-Benzodiazepine-2,5-dione scaffold, 2
C[C@H](c1ccc(Cl)cc1N)N1C(=O)c2cc(I)ccc2N(CCCCC(=O)O)C(=O)[C@@H]1c1ccc(Cl)cc1
|
C28H26Cl2IN3O4 666.343000 |
SAGXSWWCECPDLO-DXPJPUQTSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM31288; PubChem:CID11952783
|
Local ready
Direct docking supported
|