| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L014021
BDB014021
|
US9611224, Example 49u
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(-c4ccccc4)ccc23)C1=O
|
C32H33N3O3 507.634000 |
CAEFEEHGSMVTAZ-KMRXNPHXSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314347; PubChem:CID72949461
|
Local ready
Direct docking supported
|
|
E3L014022
BDB014022
|
US9611224, Example 52b
CCCS(=O)(=O)NC(=O)c1cccc2c(CN3C(=O)[C@@H](NC(=O)[C@H](C)NC)CCc4ccccc43)c(OC)ccc12
|
C30H36N4O6S 580.707000 |
REQYCTGDIZBDQC-DFBJGRDBSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314348; PubChem:CID89923563
|
Local ready
Direct docking supported
|
|
E3L014023
BDB014023
|
US9611224, Example 52c
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3c(C(=O)NS(C)(=O)=O)cccc23)C1=O
|
C28H32N4O6S 552.653000 |
OCCUIDMAGSNUDV-SBUREZEXSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314349; PubChem:CID72949640
|
Local ready
Direct docking supported
|
|
E3L014024
BDB014024
|
US9611224, Example 52d
CCCS(=O)(=O)NC(=O)c1ccc2c(CN3C(=O)[C@@H](NC(=O)[C@H](C)NC)CCc4ccccc43)c(OC)ccc2c1
|
C30H36N4O6S 580.707000 |
DIAXVINDQLCDGO-DFBJGRDBSA-N | Q13490 | Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314350; PubChem:CID89923082
|
Local ready
Direct docking supported
|
|
E3L014025
BDB014025
|
US9611224, Example 52e
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3c(C(=O)OC)cccc23)C1=O
|
C28H31N3O5 489.572000 |
DMTOVOJDTLJJAC-SBUREZEXSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314351; PubChem:CID72949642
|
Local ready
Direct docking supported
|
|
E3L014026
BDB014026
|
US9611224, Example 52f
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cccc3c(C(=O)O)cccc23)C1=O
|
C26H27N3O4 445.519000 |
MWGZMXNLKAOZAZ-AOMKIAJQSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314352; PubChem:CID89922880
|
Local ready
Direct docking supported
|
|
E3L014027
BDB014027
|
US9611224, Example 52g
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cccc3c(C(=O)OC)cccc23)C1=O
|
C27H29N3O4 459.546000 |
ZMCLFMIXCOGDJH-SBUREZEXSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314353; PubChem:CID72949644
|
Local ready
Direct docking supported
|
|
E3L014028
BDB014028
|
US9611224, Example 52h
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3ccc(C(=O)OC)cc23)C1=O
|
C28H31N3O5 489.572000 |
VIISZVVKHOSIGK-SBUREZEXSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314354; PubChem:CID89922883
|
Local ready
Direct docking supported
|
|
E3L014029
BDB014029
|
US9611224, Example 54b
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(C(N)=O)ccc23)C1=O
|
C27H30N4O4 474.561000 |
DULIUVCAYRZCHA-AOMKIAJQSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314355; PubChem:CID89923442
|
Local ready
Direct docking supported
|
|
E3L014030
BDB014030
|
US9611224, Example 54c
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3ccc(C#N)cc23)C1=O
|
C27H28N4O3 456.546000 |
ZETCAKGCWSPLJF-SBUREZEXSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314356; PubChem:CID89932600
|
Local ready
Direct docking supported
|
|
E3L014031
BDB014031
|
US9611224, Example 54d
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(C#N)ccc23)C1=O
|
C27H28N4O3 456.546000 |
RGAWNUSSTMETKJ-SBUREZEXSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314357; PubChem:CID89932601
|
Local ready
Direct docking supported
|
|
E3L014032
BDB014032
|
US9611224, Example 54e
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cccc3c(C#N)cccc23)C1=O
|
C26H26N4O2 426.520000 |
AHAGRPURUOHPNI-SBUREZEXSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314358; PubChem:CID89932595
|
Local ready
Direct docking supported
|
|
E3L014033
BDB014033
|
US9611224, Example 54f
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cccc3ccc(C#N)cc23)C1=O
|
C26H26N4O2 426.520000 |
JFDTUKZFAAOUNY-SBUREZEXSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314359; PubChem:CID89932598
|
Local ready
Direct docking supported
|
|
E3L014034
BDB014034
|
US9611224, Example 54g
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cccc3ccc(C(N)=O)cc23)C1=O
|
C26H28N4O3 444.535000 |
CECSVDODPZCFGO-AOMKIAJQSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314360; PubChem:CID89932596
|
Local ready
Direct docking supported
|
|
E3L014035
BDB014035
|
US9611224, Example 54h
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cccc3cccc(C#N)c23)C1=O
|
C26H26N4O2 426.520000 |
YPUYOJMZJSPEPC-JTSKRJEESA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314361; PubChem:CID89932599
|
Local ready
Direct docking supported
|
|
E3L014036
BDB014036
|
US9611224, Example 55a
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2ccccc2-c2ccccc2)C1=O
|
C27H29N3O2 427.548000 |
QTTPNZNSVLABJK-CYFREDJKSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314362; PubChem:CID118566148
|
Local ready
Direct docking supported
|
|
E3L014037
BDB014037
|
US9611224, Example 55b
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cccc(-c3ccccc3)c2)C1=O
|
C27H29N3O2 427.548000 |
BRLQSFJNHVWBQV-CYFREDJKSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314363; PubChem:CID118566149
|
Local ready
Direct docking supported
|
|
E3L014038
BDB014038
|
US9611224, Example 55c
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cc(-c3ccccc3)no2)C1=O
|
C24H26N4O3 418.497000 |
SECMTEIONZXCIJ-JXFKEZNVSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314364; PubChem:CID118566152
|
Local ready
Direct docking supported
|
|
E3L014039
BDB014039
|
US9611224, Example 55d
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2ccc(C)c(-c3ccccc3)c2)C1=O
|
C28H31N3O2 441.575000 |
SNWWBNMINQFGAX-CPJSRVTESA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314365; PubChem:CID118566150
|
Local ready
Direct docking supported
|
|
E3L014040
BDB014040
|
US9611224, Example 55f
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2ccc(-c3ccccc3)cc2)C1=O
|
C27H29N3O2 427.548000 |
YSTHVSKWCXWUDG-CYFREDJKSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314367; PubChem:CID118566151
|
Local ready
Direct docking supported
|