| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L048061
BDB048061
|
BDBM50194448
CCCN(CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N[C@@H](CO)C(=O)OC)C(C)C
|
C45H70N6O8 823.089000 |
ITTGNAWNEDCTNG-DUKNTCSXSA-N | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB
BindingDB:BDBM50194448
|
Local ready
Direct docking supported
|
|
E3L048062
BDB048062
|
Bz(4-tBu)-Phe-Val-Leu-Lys(Et2)-Ser-OMe
CCN(CC)CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1)C(C)C)C(=O)N[C@@H](CO)C(=O)OC
|
C45H70N6O8 823.089000 |
ZXFIEZQGWQBWCD-LQWITFIISA-N | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB, PubChem
BindingDB:BDBM50194449; PubChem:CID134134858
|
Local ready
Direct docking supported
|
|
E3L048063
BDB048063
|
Bz(4-tBu)-Phe-Ala-Leu-Lys(Et2)-Ser-OH
CCN(CC)CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N[C@@H](CO)C(=O)O
|
C42H64N6O8 781.008000 |
PBCHJNMDDNVDMG-HCJIVJCNSA-N | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB, PubChem
BindingDB:BDBM50194450; PubChem:CID102602634
|
Local ready
Direct docking supported
|
|
E3L048064
BDB048064
|
Bz(4-tBu)-Phe-Ala-Leu-Lys(Et2)-Gly-ol
CCN(CC)CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NCCO
|
C41H64N6O6 736.999000 |
AEXWIZIRHCUOMT-HNJBERQJSA-N | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB, PubChem
BindingDB:BDBM50194457; PubChem:CID134154055
|
Local ready
Direct docking supported
|
|
E3L048065
BDB048065
|
Bz(4-tBu)-Phe(4-MeNH2)-Ala-Leu-Lys(Et2)-Ser-OMe
CCN(CC)CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(CN)cc1)NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N[C@@H](CO)C(=O)OC
|
C44H69N7O8 824.077000 |
IQFBELGVMQWYDI-FETRQNOVSA-N | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB, PubChem
BindingDB:BDBM50194458; PubChem:CID134156251
|
Local ready
Direct docking supported
|
|
E3L048066
BDB048066
|
Bz-Gly-Phe-Ala-Leu-Lys-Ser-OMe
COC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)c1ccccc1
|
C37H53N7O9 739.871000 |
SSBGKJYMHDNYHV-QALZTRBASA-N | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB, PubChem
BindingDB:BDBM50194459; PubChem:CID134142297
|
Local ready
Direct docking supported
|
|
E3L048067
BDB048067
|
Bz-Ala-Leu-Lys(Me3)-NHMe
CNC(=O)[C@H](CCCC[N+](C)(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)c1ccccc1
|
C26H44N5O4+ 490.669000 |
TXRQVSMPFCHELS-BVSLBCMMSA-O | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB, PubChem
BindingDB:BDBM50194460; PubChem:CID134145736
|
Local ready
Direct docking supported
|
|
E3L048068
BDB048068
|
Bz(4-tBu)-Phe-Abu-Leu-Lys(Et2)-Ser-OMe
CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN(CC)CC)C(=O)N[C@@H](CO)C(=O)OC
|
C44H68N6O8 809.062000 |
YUNDLGQJZQUDNB-LTLCPEALSA-N | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB, PubChem
BindingDB:BDBM50194462; PubChem:CID134133875
|
Local ready
Direct docking supported
|
|
E3L048069
BDB048069
|
Bz-Gly-Phe-Ala-Leu-Lys(Et2)-Ser-OMe
CCN(CC)CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)c1ccccc1)C(=O)N[C@@H](CO)C(=O)OC
|
C41H61N7O9 795.979000 |
LVLHGUOJFJEUQP-KMACTHOASA-N | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB, PubChem
BindingDB:BDBM50194463; PubChem:CID102602632
|
Local ready
Direct docking supported
|
|
E3L048070
BDB048070
|
BDBM50194464
CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1)C(=O)NCCCCC[N+](C)(C)C
|
C33H50N5O4+ 580.794000 |
FCUVIHIUNUOUJE-FMYROPPKSA-O | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB, PubChem
BindingDB:BDBM50194464; PubChem:CID134133965
|
Local ready
Direct docking supported
|
|
E3L048071
BDB048071
|
Bz-Phe-Ala-Leu-Lys(Me3)-Ser-OMe
COC(=O)[C@H](CO)NC(=O)[C@H](CCCC[N+](C)(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1
|
C38H57N6O8+ 725.908000 |
KWZNJTOCNMNMAZ-LJEIBCANSA-O | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB, PubChem
BindingDB:BDBM50194465; PubChem:CID134157612
|
Local ready
Direct docking supported
|
|
E3L048072
BDB048072
|
Bz(4-tBu)-Phe-Ala-Leu-Lys(Me3)-Ser-OMe
COC(=O)[C@H](CO)NC(=O)[C@H](CCCC[N+](C)(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1
|
C42H65N6O8+ 782.016000 |
VWQADHAJYDYFRH-HCJIVJCNSA-O | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB, PubChem
BindingDB:BDBM50194466; PubChem:CID134155339
|
Local ready
Direct docking supported
|
|
E3L048073
BDB048073
|
BDBM50194467
COC(=O)[C@H](CO)NC(=O)[C@H](CCCCN(C)C1CNC1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)c1ccccc1
|
C41H60N8O9 808.978000 |
BIMYZGLGQWJLIM-YNUAGZMFSA-N | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB
BindingDB:BDBM50194467
|
Local ready
Direct docking supported
|
|
E3L048074
BDB048074
|
Bz-Gly-Phe-Ala-Leu-Nle(piperidino)-Ser-OMe
COC(=O)[C@H](CO)NC(=O)[C@H](CCCCN1CCCCC1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)c1ccccc1
|
C42H61N7O9 807.990000 |
YMGXCYQJAWUXNG-VYKSXFOXSA-N | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB, PubChem
BindingDB:BDBM50194468; PubChem:CID134149994
|
Local ready
Direct docking supported
|
|
E3L048075
BDB048075
|
Bz(4-OMe)-Phe-Ala-Leu-Lys(Et2)-Ser-OMe
CCN(CC)CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(OC)cc1)C(=O)N[C@@H](CO)C(=O)OC
|
C40H60N6O9 768.953000 |
VXBVPENBQFGYRJ-YNUAGZMFSA-N | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB, PubChem
BindingDB:BDBM50194469; PubChem:CID134149299
|
Local ready
Direct docking supported
|
|
E3L048076
BDB048076
|
BDBM50194470
COC(=O)[C@H](CO)NC(=O)[C@H](CCCCNC1C2CC3CC(C2)CC1C3)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)c1ccccc1
|
C47H67N7O9 874.093000 |
UCRSNRWWVDEHLO-JXGGDCLASA-N | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB
BindingDB:BDBM50194470
|
Local ready
Direct docking supported
|
|
E3L048077
BDB048077
|
BDBM50194471
CCN(CC)CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(C(=O)OC)cc1)C(=O)N[C@@H](CO)C(=O)OC
|
C41H60N6O10 796.963000 |
ZEQPUKRMOYRHJH-YNUAGZMFSA-N | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB
BindingDB:BDBM50194471
|
Local ready
Direct docking supported
|
|
E3L048078
BDB048078
|
Bz-Ala-Leu-Lys(Me3)-Ser-OMe
COC(=O)[C@H](CO)NC(=O)[C@H](CCCC[N+](C)(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)c1ccccc1
|
C29H48N5O7+ 578.731000 |
CYGWLCBRYLFZSB-BIHRQFPBSA-O | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB, PubChem
BindingDB:BDBM50194472; PubChem:CID134151077
|
Local ready
Direct docking supported
|
|
E3L048079
BDB048079
|
Bz(2-Me)-Phe-Ala-Leu-Lys(Et2)-Ser-OMe
CCN(CC)CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1C)C(=O)N[C@@H](CO)C(=O)OC
|
C40H60N6O8 752.954000 |
HQOYGLASHKRVBV-KMACTHOASA-N | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB, PubChem
BindingDB:BDBM50194473; PubChem:CID134143576
|
Local ready
Direct docking supported
|
|
E3L048080
BDB048080
|
BDBM50194474
CCc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN(CC)CC)C(=O)N[C@@H](CO)C(=O)OC)cc1
|
C41H62N6O8 766.981000 |
SOGNIQLFQOQYGJ-HCJIVJCNSA-N | O00257 | E3 SUMO-protein ligase CBX4 |
BindingDB
BindingDB:BDBM50194474
|
Local ready
Direct docking supported
|