| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L009521
BDB009521
|
BDBM214629
CN1CCN(C(=O)c2cc(Cc3n[nH]c(=O)c4c3CCCC4)ccc2F)CC1=O
|
C21H23FN4O3 398.438000 |
HDLJQIBCSHHBRK-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM214629; PubChem:CID69324237
|
Local ready
Direct docking supported
|
|
E3L009522
BDB009522
|
BDBM214630
CCN(CCNC(=O)C1CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3c2CCCC3)ccc1F
|
C24H29FN4O3 440.519000 |
QMNZVIMRMTZVMS-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM214630; PubChem:CID69318212
|
Local ready
Direct docking supported
|
|
E3L009523
BDB009523
|
BDBM214631
CCN(CCNC(=O)c1c(F)cccc1F)C(=O)c1cc(Cc2n[nH]c(=O)c3c2CCCC3)ccc1F
|
C27H27F3N4O3 512.532000 |
QJQIFVXKNXXNIX-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM214631; PubChem:CID69321750
|
Local ready
Direct docking supported
|
|
E3L009524
BDB009524
|
BDBM214632
CCN(CCNC(=O)c1cccnc1)C(=O)c1cc(Cc2n[nH]c(=O)c3c2CCCC3)ccc1F
|
C26H28FN5O3 477.540000 |
ZRIGZVRNMGGHGK-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM214632; PubChem:CID69321974
|
Local ready
Direct docking supported
|
|
E3L009525
BDB009525
|
BDBM214661
Cc1cc(C)cc(-c2nc3nc(C(=O)O)nc(N[C@H](C)C4CCC4)c3n2Cc2ccc(C(F)(F)F)cc2)c1
|
C28H28F3N5O2 523.559000 |
JHQSOYUROCGANZ-QGZVFWFLSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM214661; PubChem:CID90319807
|
Local ready
Direct docking supported
|
|
E3L009526
BDB009526
|
BDBM214662
Cc1ccc(Cl)cc1-c1nc2nc(C(=O)O)nc(N[C@H](C)C3CCC3)c2n1Cc1ccc(C(F)(F)F)cc1
|
C27H25ClF3N5O2 543.977000 |
QXCOSKRZFKKODQ-OAHLLOKOSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM214662; PubChem:CID90325348
|
Local ready
Direct docking supported
|
|
E3L009527
BDB009527
|
BDBM214663
COc1ccc2cc(-c3nc4nc(C(=O)O)nc(N[C@H](C)C5CCC5)c4n3Cc3ccc(C(F)(F)F)cc3)ccc2c1
|
C31H28F3N5O3 575.591000 |
YOEYNAJYMWNVNI-QGZVFWFLSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM214663; PubChem:CID90325349
|
Local ready
Direct docking supported
|
|
E3L009528
BDB009528
|
BDBM214664
COc1c(C)cc(-c2nc3nc(C(=O)O)nc(N[C@H](C)C4CCC4)c3n2Cc2ccc(C(F)(F)F)cc2)cc1C
|
C29H30F3N5O3 553.585000 |
VHUZDXNGHXKISW-QGZVFWFLSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM214664; PubChem:CID90325352
|
Local ready
Direct docking supported
|
|
E3L009529
BDB009529
|
BDBM214666
C[C@@H](Nc1nc(C(=O)O)nc2nc(-c3ncccc3C(F)(F)F)n(Cc3ccc(C(F)(F)F)cc3)c12)C1CCC1
|
C26H22F6N6O2 564.490000 |
MZKQQPXHBQUFBZ-CYBMUJFWSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM214666; PubChem:CID90325353
|
Local ready
Direct docking supported
|
|
E3L009530
BDB009530
|
BDBM214667
COc1ccc(-c2nc3nc(C(=O)O)nc(N[C@H](C)C4CCC4)c3n2Cc2ccc(C(F)(F)F)cc2)c(F)c1
|
C27H25F4N5O3 543.521000 |
PVERZPWPVKPSSP-CQSZACIVSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM214667; PubChem:CID90325350
|
Local ready
Direct docking supported
|
|
E3L009531
BDB009531
|
BDBM214674
Cc1cc(-c2nc3nc(C(=O)O)nc(N[C@H](C)C4CCC4)c3n2Cc2ccc(C(F)(F)F)cc2)ccc1F
|
C27H25F4N5O2 527.522000 |
FBXGGYZKHQDEHN-OAHLLOKOSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM214674; PubChem:CID90325351
|
Local ready
Direct docking supported
|
|
E3L009532
BDB009532
|
BDBM214676
CCOc1ccc(C)cc1-c1nc2nc(C(=O)O)nc(N[C@H](C)C3CCC3)c2n1Cc1ccc(C(F)(F)F)cc1
|
C29H30F3N5O3 553.585000 |
YMNXOZUSYMBGPB-QGZVFWFLSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM214676; PubChem:CID118558871
|
Local ready
Direct docking supported
|
|
E3L009533
BDB009533
|
BDBM214691
COc1cccc(-c2nc3nc(C(=O)O)nc(N[C@H](C)C4CCC4)c3n2Cc2ccc(C(F)(F)F)cc2)c1
|
C27H26F3N5O3 525.531000 |
ATKNLCBOHWZVJU-OAHLLOKOSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM214691; PubChem:CID90325019
|
Local ready
Direct docking supported
|
|
E3L009534
BDB009534
|
BDBM214692
Cc1cc(C2CC2)ccc1-c1nc2nc(C(=O)O)nc(N[C@H](C)C3CCC3)c2n1Cc1ccc(C(F)(F)F)cc1
|
C30H30F3N5O2 549.597000 |
IAZJJDHQIWDMRO-QGZVFWFLSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM214692; PubChem:CID90325008
|
Local ready
Direct docking supported
|
|
E3L009535
BDB009535
|
BDBM214969
C[C@@H](Nc1nc(C(=O)O)nc2nc(Cc3ccccc3)n(Cc3ccc(C(F)(F)F)cc3)c12)C1CCC1
|
C27H26F3N5O2 509.532000 |
XADSATGDEDKQCA-MRXNPFEDSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM214969; PubChem:CID90319681
|
Local ready
Direct docking supported
|
|
E3L009536
BDB009536
|
BDBM214988
C[C@@H](Nc1nc(C(=O)O)nc2nc(C3CCCCC3)n(Cc3ccc(C(F)(F)F)cc3)c12)C1CCC1
|
C26H30F3N5O2 501.553000 |
MDVJQRREBNQFSA-OAHLLOKOSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM214988; PubChem:CID90325009
|
Local ready
Direct docking supported
|
|
E3L009537
BDB009537
|
BDBM214990
C[C@@H](Nc1nc(C(=O)O)nc2nc(-c3cccc(Cl)c3)n(Cc3ccc(Cl)cc3)c12)C1CC1
|
C24H21Cl2N5O2 482.371000 |
JYDQRAAQTMSBNB-CYBMUJFWSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM214990; PubChem:CID90318765
|
Local ready
Direct docking supported
|
|
E3L009538
BDB009538
|
BDBM214991
Cc1cccc(-c2nc3nc(C(=O)O)nc(N[C@H](C)C4CC4)c3n2Cc2ccc(Cl)cc2)c1
|
C25H24ClN5O2 461.953000 |
GXSLLOOMHTUMQZ-OAHLLOKOSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM214991; PubChem:CID90325007
|
Local ready
Direct docking supported
|
|
E3L009539
BDB009539
|
BDBM215010
C[C@@H](Nc1nc(C(=O)O)nc2nc(-c3ccc4sccc4c3)n(Cc3ccc(Cl)cc3)c12)C1CC1
|
C26H22ClN5O2S 504.015000 |
VYDVBUHEXZQWED-CQSZACIVSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM215010; PubChem:CID90319650
|
Local ready
Direct docking supported
|
|
E3L009540
BDB009540
|
BDBM215013
Cc1cccc(-c2nc3nc(C(=O)O)nc(N[C@H](C)C4CC4)c3n2Cc2ccc(C(F)(F)F)cc2)c1
|
C26H24F3N5O2 495.505000 |
RAJOACLFGRXNQW-OAHLLOKOSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM215013; PubChem:CID90325357
|
Local ready
Direct docking supported
|