| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L010721
BDB010721
|
BDBM224300
Cc1cccc(-c2nc3nc(C(=O)O)nc(N[C@H](C)C4CC4)c3n2CC2CCC(C(F)(F)F)CC2)c1
|
C26H30F3N5O2 501.553000 |
QGVJPMCAJMOYPW-MDCZIUGASA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM224300; PubChem:CID90318239
|
Local ready
Direct docking supported
|
|
E3L010722
BDB010722
|
BDBM224301
Cc1cccc(-c2nc3nc(C(=O)O)nc(N[C@H](C)C4CC4)c3n2CC2CCC(C(F)(F)F)CC2)c1
|
C26H30F3N5O2 501.553000 |
QGVJPMCAJMOYPW-MDCZIUGASA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM224301; PubChem:CID90318239
|
Local ready
Direct docking supported
|
|
E3L010723
BDB010723
|
BDBM224303
Cc1cccc(-c2nc3nc(C(=O)O)nc(N[C@H](C)C4CCC4)c3n2C[C@H]2CC[C@@H](C(F)(F)F)CC2)c1
|
C27H32F3N5O2 515.580000 |
YGNMXSDBIBVULN-HLIPFELVSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM224303
|
Local ready
Direct docking supported
|
|
E3L010724
BDB010724
|
BDBM224304
CC(C)c1ccnc(-c2nc3nc(-c4noc(=O)[nH]4)nc(N[C@H](C)C4CCC4)c3n2C[C@H]2CC[C@H](C(F)(F)F)CC2)c1
|
C29H35F3N8O2 584.647000 |
NWSNBXSBQKXANL-MBOZVWFJSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM224304
|
Local ready
Direct docking supported
|
|
E3L010725
BDB010725
|
BDBM224305
CC1CCC(Cn2c(N3CCOC[C@H]3C)nc3nc(-c4noc(=O)[nH]4)nc(N[C@H](C)C4CCC4)c32)CC1(F)F
|
C26H36F2N8O3 546.623000 |
JIHYBCSXGGVPIW-JCCCHCCOSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM224305; PubChem:CID136632555
|
Local ready
Direct docking supported
|
|
E3L010726
BDB010726
|
BDBM224307
CC([C@H]1CC[C@H](C)CC1)n1c(N2CCOC[C@H]2C)nc2nc(-c3noc(=O)[nH]3)nc(-c3cccc(Cl)c3)c21
|
C27H32ClN7O3 538.052000 |
NDHWNBVLMRGVAY-KTBGXXAUSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM224307
|
Local ready
Direct docking supported
|
|
E3L010727
BDB010727
|
BDBM224309
CC([C@H]1CC[C@H](C)CC1)n1c(N2CCOC[C@H]2C)nc2nc(-c3n[nH]c(=O)o3)nc(-c3cccc(Cl)c3)c21
|
C27H32ClN7O3 538.052000 |
WUDIPTKAOIVYTI-KTBGXXAUSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM224309
|
Local ready
Direct docking supported
|
|
E3L010728
BDB010728
|
BDBM224311
CC([C@H]1CC[C@H](C)CC1)n1c(N2CCOC3CCCC32)nc2nc(-c3noc(=O)[nH]3)nc(-c3cccc(Cl)c3)c21
|
C29H34ClN7O3 564.090000 |
IVEGEKQROAZNFA-SUNPUCKGSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM224311
|
Local ready
Direct docking supported
|
|
E3L010729
BDB010729
|
BDBM224312
CC([C@H]1CC[C@H](C)CC1)n1c(N2CCOC3CCCC32)nc2nc(-c3noc(=O)[nH]3)nc(N[C@H](C)C3CCC3)c21
|
C29H42N8O3 550.708000 |
IQOOFHYDSYOUEU-GOYHKYKJSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM224312
|
Local ready
Direct docking supported
|
|
E3L010730
BDB010730
|
BDBM224313
CC([C@H]1CC[C@H](C)CC1)n1c(N2CCOC3CCCC32)nc2nc(-c3n[nH]c(=O)o3)nc(-c3cccc(Cl)c3)c21
|
C29H34ClN7O3 564.090000 |
XNWPVENFUDXILR-SUNPUCKGSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM224313
|
Local ready
Direct docking supported
|
|
E3L010731
BDB010731
|
BDBM224318
CC([C@H]1CC[C@H](C)CC1)n1c(N2CCOC3CCCC32)nc2nc(-c3n[nH]c(=O)o3)nc(N[C@H](C)C3CCC3)c21
|
C29H42N8O3 550.708000 |
JWRFCMPSRZBFJE-GOYHKYKJSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM224318
|
Local ready
Direct docking supported
|
|
E3L010732
BDB010732
|
BDBM224319
CC([C@H]1CC[C@H](C)CC1)n1c(N2CCC[C@H]2CF)nc2nc(-c3noc(=O)[nH]3)nc(-c3cncc(Cl)c3)c21
|
C26H30ClFN8O2 541.031000 |
SJEGZHVTJUSIAG-UVZNFPTASA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM224319
|
Local ready
Direct docking supported
|
|
E3L010733
BDB010733
|
BDBM224321
CC([C@H]1CC[C@H](C)CC1)n1c(N2CCC[C@H]2CF)nc2nc(-c3n[nH]c(=O)o3)nc(-c3cncc(Cl)c3)c21
|
C26H30ClFN8O2 541.031000 |
QOUVOZVYMFPRDH-UVZNFPTASA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM224321
|
Local ready
Direct docking supported
|
|
E3L010734
BDB010734
|
BDBM224323
CC([C@H]1CC[C@H](C)CC1)n1c(N2CCC[C@H]2C(F)(F)F)nc2nc(-c3noc(=O)[nH]3)nc(-c3cncc(Cl)c3)c21
|
C26H28ClF3N8O2 577.011000 |
UDYZPNJPGMDGEM-XGVZATPDSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM224323
|
Local ready
Direct docking supported
|
|
E3L010735
BDB010735
|
BDBM224628
CC1(C)CCC2=C(C1)c1n[nH]c(=O)c3cccc(c13)N2
|
C16H17N3O 267.332000 |
BDGRZWISYNXFKD-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB
BindingDB:BDBM224628
|
Local ready
Direct docking supported
|
|
E3L010736
BDB010736
|
BDBM224629
O=c1[nH]nc2c3c(cccc13)NC1=C2CCCC1
|
C14H13N3O 239.278000 |
YTZCTEISEKPJTQ-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB
BindingDB:BDBM224629
|
Local ready
Direct docking supported
|
|
E3L010737
BDB010737
|
BDBM224630
O=c1[nH]nc2c3c(cccc13)NC1=C2CCCCCC1
|
C16H17N3O 267.332000 |
ZGDNFPWQEQSQAA-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB
BindingDB:BDBM224630
|
Local ready
Direct docking supported
|
|
E3L010738
BDB010738
|
BDBM224631
O=c1[nH]nc2c3c(cccc13)NC1=C2CCCCC1
|
C15H15N3O 253.305000 |
KXXRGTYOVUETBV-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB
BindingDB:BDBM224631
|
Local ready
Direct docking supported
|
|
E3L010739
BDB010739
|
BDBM224632
Cc1ccc2c(=O)[nH]nc3c2c1NC1=C3CCCC1
|
C15H15N3O 253.305000 |
NZZXITVESFGTFK-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB
BindingDB:BDBM224632
|
Local ready
Direct docking supported
|
|
E3L010740
BDB010740
|
BDBM224633
O=c1[nH]nc2c3c(c(Br)ccc13)NC1=C2CCCCC1
|
C15H14BrN3O 332.201000 |
LLXUUALZHBBOIO-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB
BindingDB:BDBM224633
|
Local ready
Direct docking supported
|