| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L013901
BDB013901
|
US9611224, Example 26
CN[C@@H](C)C(=O)NC1CCc2ccc(Br)cc2N(Cc2ccccc2)C1=O
|
C21H24BrN3O2 430.346000 |
ZFTHDLBDEFCGJQ-PIVQAISJSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314214; PubChem:CID89922701
|
Local ready
Direct docking supported
|
|
E3L013902
BDB013902
|
US9611224, Example 28
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cccc3ccc(-c4nnn[nH]4)cc23)C1=O
|
C26H27N7O2 469.549000 |
GISZCWNNRGUZAZ-AOMKIAJQSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314216; PubChem:CID72950321
|
Local ready
Direct docking supported
|
|
E3L013903
BDB013903
|
US9611224, Example 30
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(-c4nc(C)cs4)ccc23)C1=O
|
C30H32N4O3S 528.678000 |
RTQRXHUARVYIRK-DFBJGRDBSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314218; PubChem:CID72950323
|
Local ready
Direct docking supported
|
|
E3L013904
BDB013904
|
BDBM314219
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(-c4noc(=O)[nH]4)ccc23)C1=O
|
C28H29N5O5 515.570000 |
DADRFTJNWMVGRT-AOMKIAJQSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314219; PubChem:CID136274875
|
Local ready
Direct docking supported
|
|
E3L013905
BDB013905
|
US9611224, Example 32
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(-c4ncon4)ccc23)C1=O
|
C28H29N5O4 499.571000 |
DSVXWYOPVCLCIM-SBUREZEXSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314220; PubChem:CID72950484
|
Local ready
Direct docking supported
|
|
E3L013906
BDB013906
|
US9611224, Example 33
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(C(=N)NN)ccc23)C1=O
|
C27H32N6O3 488.592000 |
ZRXGQVDJIIYRDL-AOMKIAJQSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314221; PubChem:CID72950486
|
Local ready
Direct docking supported
|
|
E3L013907
BDB013907
|
BDBM314222
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(-c4n[nH]c(=O)[nH]4)ccc23)C1=O
|
C28H30N6O4 514.586000 |
PXFAXQATWOVNJG-AOMKIAJQSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314222; PubChem:CID136274883
|
Local ready
Direct docking supported
|
|
E3L013908
BDB013908
|
BDBM314223
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(-c4n[nH]c(=O)c(=O)[nH]4)ccc23)C1=O
|
C29H30N6O5 542.596000 |
WMXIKWQRFXAXCC-AOMKIAJQSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB
BindingDB:BDBM314223
|
Local ready
Direct docking supported
|
|
E3L013909
BDB013909
|
US9611224, Example 36
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(-c4nnc(C(F)(F)F)[nH]4)ccc23)C1=O
|
C29H29F3N6O3 566.584000 |
YNPOZDBHCPAYNI-AOMKIAJQSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314224; PubChem:CID72950492
|
Local ready
Direct docking supported
|
|
E3L013910
BDB013910
|
US9611224, Example 37
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(-c4nccnn4)ccc23)C1=O
|
C29H30N6O3 510.598000 |
LVUXPCTUCJKBKS-UUOWRZLLSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314225; PubChem:CID72950650
|
Local ready
Direct docking supported
|
|
E3L013911
BDB013911
|
US9611224, Example 38
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(-c4nc[nH]n4)ccc23)C1=O
|
C28H30N6O3 498.587000 |
ZBZUZOWZCHMITB-SBUREZEXSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314226; PubChem:CID89923676
|
Local ready
Direct docking supported
|
|
E3L013912
BDB013912
|
US9611224, Example 39
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(-c4nnn[nH]4)ccc23)C1=O
|
C27H29N7O3 499.575000 |
PVKXZHIHTMGNPQ-AOMKIAJQSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314227; PubChem:CID72950652
|
Local ready
Direct docking supported
|
|
E3L013913
BDB013913
|
US9611224, Example 40
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(-c4nnn(C)n4)ccc23)C1=O
|
C28H31N7O3 513.602000 |
UTBMVMKJMPUZEH-SBUREZEXSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314228; PubChem:CID72950654
|
Local ready
Direct docking supported
|
|
E3L013914
BDB013914
|
US9611224, Example 41
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(-c4nnnn4C)ccc23)C1=O
|
C28H31N7O3 513.602000 |
BNOGQJRJAXZVON-SBUREZEXSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314229; PubChem:CID72950656
|
Local ready
Direct docking supported
|
|
E3L013915
BDB013915
|
US9611224, Example 42
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(NC(C)=O)ccc23)C1=O
|
C28H32N4O4 488.588000 |
QQPLMKANTFVBLD-XDHUDOTRSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314230; PubChem:CID72950658
|
Local ready
Direct docking supported
|
|
E3L013916
BDB013916
|
US9611224, Example 43
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(-c4cn[nH]c4)ccc23)C1=O
|
C29H31N5O3 497.599000 |
MGXALJYQTMECKK-BVZFJXPGSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314231; PubChem:CID72950823
|
Local ready
Direct docking supported
|
|
E3L013917
BDB013917
|
US9611224, Example 44
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3c2CCCC3)C1=O
|
C26H33N3O3 435.568000 |
CUCRCBZAXMOCQF-JTSKRJEESA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314232; PubChem:CID89923370
|
Local ready
Direct docking supported
|
|
E3L013918
BDB013918
|
US9611224, Example 45
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(C(C)=O)ccc23)C1=O
|
C28H31N3O4 473.573000 |
ZWYKEWYNXHADHH-XDHUDOTRSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314233; PubChem:CID72950825
|
Local ready
Direct docking supported
|
|
E3L013919
BDB013919
|
US9611224, Example 46
C=Cc1ccc2c(CN3C(=O)[C@@H](NC(=O)[C@H](C)NC)CCc4ccccc43)c(OC)ccc2c1
|
C28H31N3O3 457.574000 |
GZMYNIIXRPRVKR-UUOWRZLLSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314234; PubChem:CID72950827
|
Local ready
Direct docking supported
|
|
E3L013920
BDB013920
|
US9611224, Example 47a
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(C(C)O)ccc23)C1=O
|
C28H33N3O4 475.589000 |
IKHOFZXIWHQQNU-UAYVXKRGSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314235; PubChem:CID72950829
|
Local ready
Direct docking supported
|