| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L006741
BDB006741
|
5-methyl-2-phenyl-2H-1,2,3-triazole-4-carboxamide
Cc1nn(-c2ccccc2)nc1C(N)=O
|
C10H10N4O 202.217000 |
IHPOVUXVIZRYAC-UHFFFAOYSA-N | Q92831 | Histone acetyltransferase KAT2B |
BindingDB, PubChem
BindingDB:BDBM152260; PubChem:CID2774349
|
Local ready
Direct docking supported
|
|
E3L006742
BDB006742
|
BDBM152940
CCN(C(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@](C#N)(c3ccc(Cl)cc3F)[C@H]2c2cccc(Cl)c2F)c(OC)c1)C(C)C
|
C39H44Cl2F2N4O6 773.705000 |
VAMATPCODPZMHW-WNCLNVGJSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM152940
|
Local ready
Direct docking supported
|
|
E3L006743
BDB006743
|
BDBM152941
COc1cc(C(=O)OCOP(=O)(OC(C)(C)C)OC(C)(C)C)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](C#N)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C40H48Cl2F2N3O8P 838.713000 |
HWLXCKNQDCDKCZ-OMFQFALRSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM152941
|
Local ready
Direct docking supported
|
|
E3L006744
BDB006744
|
BDBM152942
COCCN(CCOC)C(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@](C#N)(c3ccc(Cl)cc3F)[C@H]2c2cccc(Cl)c2F)c(OC)c1
|
C40H46Cl2F2N4O8 819.730000 |
XMFSTNNAYMUVLR-CQVPIWLESA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM152942
|
Local ready
Direct docking supported
|
|
E3L006745
BDB006745
|
BDBM152943
COc1cc(C(=O)OC(C)OC(=O)N2CCN(C)CC2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](C#N)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C39H43Cl2F2N5O6 786.704000 |
GIGBEMHAWPVMJG-WNCLNVGJSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM152943
|
Local ready
Direct docking supported
|
|
E3L006746
BDB006746
|
BDBM152944
COc1cc(C(=O)OC(C)OC(C)=O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](C#N)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C35H35Cl2F2N3O6 702.582000 |
PGFFNMFTAXMQDQ-BGNMFIKXSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM152944; PubChem:CID71738808
|
Local ready
Direct docking supported
|
|
E3L006747
BDB006747
|
BDBM152945
COc1cc(C(=O)OC(C)OC(=O)C(C)C)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](C#N)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C37H39Cl2F2N3O6 730.636000 |
XYAMNPCOTRBECJ-SWYSKLGISA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM152945
|
Local ready
Direct docking supported
|
|
E3L006748
BDB006748
|
BDBM152946
COc1cc(C(=O)OCOC(C)=O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](C#N)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C34H33Cl2F2N3O6 688.555000 |
NFGURRMLWOPUIN-QGHWIGIDSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM152946
|
Local ready
Direct docking supported
|
|
E3L006749
BDB006749
|
BDBM152947
COc1cc(C(=O)OC(C)OC(=O)OC2CCCCC2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](C#N)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C40H43Cl2F2N3O7 786.700000 |
FCLKTFOPWRWBKR-FQYWPQLQSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM152947
|
Local ready
Direct docking supported
|
|
E3L006750
BDB006750
|
BDBM152948
COc1cc(C(=O)OC(C)OC(=O)OC(C)C)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](C#N)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C37H39Cl2F2N3O7 746.635000 |
VEVRMDKPVHDOEI-SWYSKLGISA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM152948
|
Local ready
Direct docking supported
|
|
E3L006751
BDB006751
|
BDBM152949
COc1cc(C(=O)OC(C)OC(=O)N2CCOCC2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](C#N)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C38H40Cl2F2N4O7 773.661000 |
HSPLQOYQAJREPF-WZIYDBIHSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM152949
|
Local ready
Direct docking supported
|
|
E3L006752
BDB006752
|
BDBM152950
COc1cc(C(=O)O[C@@H](C)OC(=O)N2CCOCC2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](C#N)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C38H40Cl2F2N4O7 773.661000 |
HSPLQOYQAJREPF-MESXDJAKSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM152950
|
Local ready
Direct docking supported
|
|
E3L006753
BDB006753
|
BDBM152951
COc1cc(C(=O)OC(C)OC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](C#N)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C43H49Cl2F2N5O8 872.794000 |
CNATXTMTIHBORA-URESCKQOSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM152951
|
Local ready
Direct docking supported
|
|
E3L006754
BDB006754
|
BDBM152952
COc1cc(C(=O)OC(C)OC(=O)N2CCNCC2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](C#N)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C38H41Cl2F2N5O6 772.677000 |
FWVVDYWFUZNHBG-WZIYDBIHSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM152952
|
Local ready
Direct docking supported
|
|
E3L006755
BDB006755
|
BDBM152953
COc1cc(C(=O)OC(C)OC(=O)N2CCS(=O)(=O)CC2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](C#N)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C38H40Cl2F2N4O8S 821.727000 |
KANPOEWQJMBNAF-WZIYDBIHSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM152953
|
Local ready
Direct docking supported
|
|
E3L006756
BDB006756
|
BDBM152954
COc1cc(C(=O)OC(C)OC(=O)NCC2COC(C)(C)O2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](C#N)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C40H44Cl2F2N4O8 817.714000 |
CNXFBFCFWIACDG-QYAOOTFGSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM152954
|
Local ready
Direct docking supported
|
|
E3L006757
BDB006757
|
BDBM152955
COc1cc(C(=O)OC(C)OC(=O)NCC(O)CO)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](C#N)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C37H40Cl2F2N4O8 777.649000 |
CJAGLCLDEDPZNP-YKZSQUMLSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM152955
|
Local ready
Direct docking supported
|
|
E3L006758
BDB006758
|
BDBM152956
COc1cc(C(=O)OC(C)OC(=O)NC2CCOCC2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](C#N)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C39H42Cl2F2N4O7 787.688000 |
QCJRSRWTRISYKN-PODIEFLSSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM152956
|
Local ready
Direct docking supported
|
|
E3L006759
BDB006759
|
BDBM152957
COCCOCCOCCOC(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@](C#N)(c3ccc(Cl)cc3F)[C@H]2c2cccc(Cl)c2F)c(OC)c1
|
C41H47Cl2F2N3O10 850.740000 |
FHRFCMCITYBOQO-HLZUTZRQSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM152957
|
Local ready
Direct docking supported
|
|
E3L006760
BDB006760
|
BDBM152958
COCCOCCOCCOCCOC(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@](C#N)(c3ccc(Cl)cc3F)[C@H]2c2cccc(Cl)c2F)c(OC)c1
|
C43H51Cl2F2N3O11 894.793000 |
IOKYJBMBYLNZAT-YFFQEIAGSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM152958
|
Local ready
Direct docking supported
|