| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L062641
BDB062641
|
BDBM50604873
CCCC(=O)N1CCc2cc(NS(=O)(=O)c3cc(C4CC4)ccc3OC)ccc21
|
C22H26N2O4S 414.527000 |
LDYJSGRRCNKDIG-UHFFFAOYSA-N | O15164 | Transcription intermediary factor 1-alpha |
BindingDB, PubChem
BindingDB:BDBM50604873; PubChem:CID168282306
|
Local ready
Direct docking supported
|
|
E3L062642
BDB062642
|
BDBM50604874
COc1ccc(C2CC2)cc1S(=O)(=O)Nc1ccc2c(c1)CCN2C(=O)C(C)C
|
C22H26N2O4S 414.527000 |
OVCJAMSITCEXKC-UHFFFAOYSA-N | O15164 | Transcription intermediary factor 1-alpha |
BindingDB, PubChem
BindingDB:BDBM50604874; PubChem:CID168297290
|
Local ready
Direct docking supported
|
|
E3L062643
BDB062643
|
BDBM50604875
COc1ccc(C2CC2)cc1S(=O)(=O)Nc1ccc2c(c1)CCN2C(=O)C1CC1
|
C22H24N2O4S 412.511000 |
DNSVKTPDWDLHAH-UHFFFAOYSA-N | O15164 | Transcription intermediary factor 1-alpha |
BindingDB, PubChem
BindingDB:BDBM50604875; PubChem:CID168283938
|
Local ready
Direct docking supported
|
|
E3L062644
BDB062644
|
BDBM50604876
COc1ccc(C2CC2)cc1S(=O)(=O)Nc1ccc2c(c1)CCN2C(=O)C(C)(C)C
|
C23H28N2O4S 428.554000 |
COFOQCZUUYGSHI-UHFFFAOYSA-N | O15164 | Transcription intermediary factor 1-alpha |
BindingDB, PubChem
BindingDB:BDBM50604876; PubChem:CID168294070
|
Local ready
Direct docking supported
|
|
E3L062645
BDB062645
|
BDBM50604885
C=CC(=O)N1CCN(c2c3ccc(-c4cccc(F)c4)cc3nn2Cc2ccccc2)CC1
|
C27H25FN4O 440.522000 |
BPENEDJSHAUQGD-UHFFFAOYSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50604885; PubChem:CID168276586
|
Local ready
Direct docking supported
|
|
E3L062646
BDB062646
|
ITE-CONHMe
CNC(=O)c1csc(C(=O)c2c[nH]c3ccccc23)n1
|
C14H11N3O2S 285.328000 |
GOVAEEIQDCTMOG-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50605060; PubChem:CID118656024
|
Local ready
Direct docking supported
|
|
E3L062647
BDB062647
|
BDBM50605061
COc1ccc(Cn2cc(C(=O)c3nccs3)c3ccccc32)cc1
|
C20H16N2O2S 348.427000 |
UKCXVSBMMYPENO-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50605061; PubChem:CID168272242
|
Local ready
Direct docking supported
|
|
E3L062648
BDB062648
|
BDBM50605062
OCc1csc(C(O)c2c[nH]c3ccccc23)n1
|
C13H12N2O2S 260.318000 |
WDHOXVYQNBYDQB-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50605062; PubChem:CID168281419
|
Local ready
Direct docking supported
|
|
E3L062649
BDB062649
|
BDBM50605102
COc1cc(C(=O)O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](C)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C31H32Cl2F2N2O4 605.509000 |
BOYCHYHLISHJKG-LJQIRTBHSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM50605102; PubChem:CID155077324
|
Local ready
Direct docking supported
|
|
E3L062650
BDB062650
|
BDBM50605103
COc1ncc(-c2nc3c(n2C(C)C)[C@H](c2ccc(Cl)cc2)N([C@@H](C)c2cccc(Cl)c2)C3=O)c(OC)n1
|
C28H27Cl2N5O3 552.462000 |
PYBJKPRTJDONOS-HJPURHCSSA-N | O15151, Q00987 | E3 ubiquitin-protein ligase Mdm2, Protein Mdm4 |
BindingDB, PubChem
BindingDB:BDBM50605103; PubChem:CID138753250
|
Local ready
Direct docking supported
|
|
E3L062651
BDB062651
|
BDBM50605104
C[C@@H](c1ccc(Cl)cc1Cl)n1cnc(-c2ccccc2)c1-c1c(C(=O)Nc2cc(C(=O)O)ccc2N2CCC(N3CCCOC3=O)CC2)[nH]c2cc(Cl)ccc12
|
C42H37Cl3N6O5 812.154000 |
GSVXCPWDMIREAJ-DEOSSOPVSA-N | O15151, Q00987 | Protein Mdm4, E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50605104
|
Local ready
Direct docking supported
|
|
E3L062652
BDB062652
|
BDBM50605105
COc1cc(C(=O)O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](CN)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C31H33Cl2F2N3O4 620.524000 |
FTIGDJCVLXFSBP-LJQIRTBHSA-N | O15151, Q00987 | E3 ubiquitin-protein ligase Mdm2, Protein Mdm4 |
BindingDB
BindingDB:BDBM50605105
|
Local ready
Direct docking supported
|
|
E3L062653
BDB062653
|
BDBM50605106
CCNC[C@]1(c2ccc(Cl)cc2F)[C@H](CC(C)(C)C)N[C@@H](C(=O)Nc2ccc(C(=O)O)cc2OC)[C@@H]1c1cccc(Cl)c1F
|
C33H37Cl2F2N3O4 648.578000 |
IHTLUCFWZSRECR-HNZCNSHZSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50605106
|
Local ready
Direct docking supported
|
|
E3L062654
BDB062654
|
BDBM50605107
CCCNC[C@]1(c2ccc(Cl)cc2F)[C@H](CC(C)(C)C)N[C@@H](C(=O)Nc2ccc(C(=O)O)cc2OC)[C@@H]1c1cccc(Cl)c1F
|
C34H39Cl2F2N3O4 662.605000 |
LOCFRNYQGYAKHB-QGHWIGIDSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50605107
|
Local ready
Direct docking supported
|
|
E3L062655
BDB062655
|
BDBM50605108
COc1cc(C(=O)O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](CNCC(=O)O)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C33H35Cl2F2N3O6 678.560000 |
LFEIWKYHJMFORH-UTIWSPQHSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50605108
|
Local ready
Direct docking supported
|
|
E3L062656
BDB062656
|
BDBM50605109
COc1cc(C(=O)O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](CNC(C)=O)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C33H35Cl2F2N3O5 662.561000 |
OIZSLHQNWGRMOZ-HNZCNSHZSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50605109
|
Local ready
Direct docking supported
|
|
E3L062657
BDB062657
|
BDBM50605110
CCC(=O)NC[C@]1(c2ccc(Cl)cc2F)[C@H](CC(C)(C)C)N[C@@H](C(=O)Nc2ccc(C(=O)O)cc2OC)[C@@H]1c1cccc(Cl)c1F
|
C34H37Cl2F2N3O5 676.588000 |
DHPQQSZQGUOUAS-PAEDPNNGSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50605110
|
Local ready
Direct docking supported
|
|
E3L062658
BDB062658
|
BDBM50605111
COc1cc(C(=O)O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](CNC(=O)C2CC2)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C35H37Cl2F2N3O5 688.599000 |
WUTHDAGKVXVWKL-ZFHKOKEKSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50605111
|
Local ready
Direct docking supported
|
|
E3L062659
BDB062659
|
BDBM50605112
COc1cc(C(=O)O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](CNC(=O)C(=O)O)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C33H33Cl2F2N3O7 692.543000 |
TTXBNAPVSVQXDD-OJABCDTNSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50605112
|
Local ready
Direct docking supported
|
|
E3L062660
BDB062660
|
BDBM50605113
COc1cc(C(=O)O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@](CNS(=O)(=O)CC(=O)O)(c2ccc(Cl)cc2F)[C@H]1c1cccc(Cl)c1F
|
C33H35Cl2F2N3O8S 742.625000 |
HYPVNEZMVHXMRL-UTIWSPQHSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB
BindingDB:BDBM50605113
|
Local ready
Direct docking supported
|