| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L047181
BDB047181
|
BDBM50165495
O=C(Nc1cccc(Cc2n[nH]c(=O)c3ccccc23)c1)c1ccc(-n2cccn2)nc1
|
C24H18N6O2 422.448000 |
VISZZGFBPNGECS-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50165495; PubChem:CID44402115
|
Local ready
Direct docking supported
|
|
E3L047182
BDB047182
|
BDBM50165496
Cc1cc(O)n(-c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)c1O
|
C20H16FN3O3 365.364000 |
FEJFVDZTEDPOTA-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50165496; PubChem:CID90763281
|
Local ready
Direct docking supported
|
|
E3L047183
BDB047183
|
BDBM50165497
O=c1[nH]nc(Cc2ccc(F)c(-n3c(O)c4c(c3O)C4)c2)c2ccccc12
|
C20H14FN3O3 363.348000 |
YYAKDDGQMGWMPK-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50165497; PubChem:CID90987340
|
Local ready
Direct docking supported
|
|
E3L047184
BDB047184
|
BDBM50165498
O=c1[nH]nc(Cc2ccc(F)c(-n3c(O)cc(-c4ccccc4)c3O)c2)c2ccccc12
|
C25H18FN3O3 427.435000 |
SXGNMFNPTJQOIT-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50165498; PubChem:CID90927523
|
Local ready
Direct docking supported
|
|
E3L047185
BDB047185
|
BDBM50165499
COc1ccc(-n2cc(C(=O)Nc3cccc(Cc4n[nH]c(=O)c5ccccc45)c3)c(C)n2)cc1
|
C27H23N5O3 465.513000 |
IDDORVJBROPAJK-UHFFFAOYSA-N | P09874 | Poly [ADP-ribose] polymerase 1 |
BindingDB, PubChem
BindingDB:BDBM50165499; PubChem:CID44402216
|
Local ready
Direct docking supported
|
|
E3L047186
BDB047186
|
BDBM50165694
O=C(c1cnccc1C(F)(F)F)N1CCCC(Oc2ccc(C(F)(F)F)cc2)(C(=O)N2CCN(c3ccccn3)CC2)C1
|
C29H27F6N5O3 607.555000 |
AQPOAKIXGJAWQW-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50165694; PubChem:CID24823666
|
Local ready
Direct docking supported
|
|
E3L047187
BDB047187
|
BDBM50165695
CCC[C@H]1N(C(=O)c2cnccc2C(F)(F)F)CCC[C@@]1(Oc1ccc(C(F)(F)F)cc1)C(=O)N1CCC(Oc2cccc(C(=O)O)n2)CC1
|
C34H34F6N4O6 708.656000 |
XIEKMGSSUSEMGG-ZUKKLESISA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50165695
|
Local ready
Direct docking supported
|
|
E3L047188
BDB047188
|
BDBM50165696
CCC[C@H]1N(C(=O)c2cnccc2C(F)(F)F)CCC[C@@]1(Oc1ccc(C(F)(F)F)cc1)C(=O)N1CCC(Oc2cccc(C(=O)OC)n2)CC1
|
C35H36F6N4O6 722.683000 |
OZOQXBOYGFJIDJ-YDYNHKSESA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50165696
|
Local ready
Direct docking supported
|
|
E3L047189
BDB047189
|
BDBM50165697
CCC[C@H]1N(C(=O)c2cnccc2C(F)(F)F)CCC[C@@]1(Oc1ccc(C(F)(F)F)cc1)C(=O)N1CCC(Oc2cccc(C(=O)NC)n2)CC1
|
C35H37F6N5O5 721.699000 |
CAXOSCBOVLZPEH-YDYNHKSESA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50165697
|
Local ready
Direct docking supported
|
|
E3L047190
BDB047190
|
BDBM50165698
CCC[C@H]1N(C(=O)c2cnccc2C(F)(F)F)CCC[C@@]1(Oc1ccc(C(F)(F)F)cc1)C(=O)N1CCC(Oc2ncccc2C(N)=O)CC1
|
C34H35F6N5O5 707.672000 |
FHXQSTAKVGGZAL-ZUKKLESISA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50165698; PubChem:CID127046361
|
Local ready
Direct docking supported
|
|
E3L047191
BDB047191
|
BDBM50165699
CCC[C@H]1N(C(=O)c2cnccc2C(F)(F)F)CCC[C@@]1(Oc1ccc(C(F)(F)F)cc1)C(=O)N1CCC(Oc2cc(C(N)=O)ccn2)CC1
|
C34H35F6N5O5 707.672000 |
UHCAFHQHBCXDJR-ZUKKLESISA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50165699; PubChem:CID127046360
|
Local ready
Direct docking supported
|
|
E3L047192
BDB047192
|
BDBM50165700
CCC[C@H]1N(C(=O)c2cnccc2C(F)(F)F)CCC[C@@]1(Oc1ccc(C(F)(F)F)cc1)C(=O)N1CCC(Oc2ccc(C(N)=O)cn2)CC1
|
C34H35F6N5O5 707.672000 |
YVSYXPKSMKSRNP-ZUKKLESISA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50165700; PubChem:CID127046167
|
Local ready
Direct docking supported
|
|
E3L047193
BDB047193
|
BDBM50165701
CCC[C@H]1N(C(=O)c2cnccc2C(F)(F)F)CCC[C@@]1(Oc1ccc(C(F)(F)F)cc1)C(=O)N1CCC(Oc2cccc(C(N)=O)n2)CC1
|
C34H35F6N5O5 707.672000 |
ROKFGLFVQZCSJL-ZUKKLESISA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50165701; PubChem:CID127045924
|
Local ready
Direct docking supported
|
|
E3L047194
BDB047194
|
BDBM50165702
CCC[C@H]1N(C(=O)c2cnccc2C(F)(F)F)CCC[C@@]1(Oc1ccc(C(F)(F)F)cc1)C(=O)N1CCC(Oc2ncccc2CN)CC1
|
C34H37F6N5O4 693.689000 |
WUOMPFJUKOHHLL-NSJVFKKDSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50165702
|
Local ready
Direct docking supported
|
|
E3L047195
BDB047195
|
BDBM50165703
CCC[C@H]1N(C(=O)c2cnccc2C(F)(F)F)CCC[C@@]1(Oc1ccc(C(F)(F)F)cc1)C(=O)N1CCC(Oc2cc(CN)ccn2)CC1
|
C34H37F6N5O4 693.689000 |
FPBCUKJZFMZDRA-NSJVFKKDSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50165703
|
Local ready
Direct docking supported
|
|
E3L047196
BDB047196
|
BDBM50165704
CCC[C@H]1N(C(=O)c2cnccc2C(F)(F)F)CCC[C@@]1(Oc1ccc(C(F)(F)F)cc1)C(=O)N1CCC(Oc2ccc(CN)cn2)CC1
|
C34H37F6N5O4 693.689000 |
QXJVCBGQTLZWKX-NSJVFKKDSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50165704
|
Local ready
Direct docking supported
|
|
E3L047197
BDB047197
|
BDBM50165705
CCC[C@H]1N(C(=O)c2cnccc2C(F)(F)F)CCC[C@@]1(Oc1ccc(C(F)(F)F)cc1)C(=O)N1CCC(Oc2cccc(CN)n2)CC1
|
C34H37F6N5O4 693.689000 |
VJMLSEYIFUGJLR-NSJVFKKDSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50165705
|
Local ready
Direct docking supported
|
|
E3L047198
BDB047198
|
BDBM50165706
CCC[C@H]1N(C(=O)c2cnccc2C(F)(F)F)CCC[C@@]1(Oc1ccc(C(F)(F)F)cc1)C(=O)N1CCC(Oc2ncccc2C#N)CC1
|
C34H33F6N5O4 689.657000 |
MEKFLEITCCMIQT-NSJVFKKDSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50165706; PubChem:CID127046502
|
Local ready
Direct docking supported
|
|
E3L047199
BDB047199
|
BDBM50165707
CCC[C@H]1N(C(=O)c2cnccc2C(F)(F)F)CCC[C@@]1(Oc1ccc(C(F)(F)F)cc1)C(=O)N1CCC(Oc2cc(C#N)ccn2)CC1
|
C34H33F6N5O4 689.657000 |
QDDIHFWHAYYHEQ-NSJVFKKDSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50165707; PubChem:CID127046501
|
Local ready
Direct docking supported
|
|
E3L047200
BDB047200
|
BDBM50165708
CCC[C@H]1N(C(=O)c2cnccc2C(F)(F)F)CCC[C@@]1(Oc1ccc(C(F)(F)F)cc1)C(=O)N1CCC(Oc2ccc(C#N)cn2)CC1
|
C34H33F6N5O4 689.657000 |
KVORRTDSYNMAIY-NSJVFKKDSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50165708; PubChem:CID59648084
|
Local ready
Direct docking supported
|