| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L013941
BDB013941
|
US9611224, Example 70
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3c(C(C)=O)cccc23)C1=O
|
C28H31N3O4 473.573000 |
PUAKCIXEYGQPPF-XDHUDOTRSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314257; PubChem:CID72949822
|
Local ready
Direct docking supported
|
|
E3L013942
BDB013942
|
US9611224, Example 1b
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2nn(C)c3ccccc23)C1=O
|
C23H27N5O2 405.502000 |
WMNBZLMLYNRQNQ-YJBOKZPZSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314258; PubChem:CID89923022
|
Local ready
Direct docking supported
|
|
E3L013943
BDB013943
|
US9611224, Example 1c
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cc(C(F)(F)F)ccc2OC)C1=O
|
C23H26F3N3O3 449.473000 |
AXEPIWOKHTZAJB-KSSFIOAISA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314259; PubChem:CID89923422
|
Local ready
Direct docking supported
|
|
E3L013944
BDB013944
|
US9611224, Example 1d
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cc(F)c(F)cc2OC)C1=O
|
C22H25F2N3O3 417.456000 |
QGHZFJRHAONFGG-UGSOOPFHSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314260; PubChem:CID89923629
|
Local ready
Direct docking supported
|
|
E3L013945
BDB013945
|
US9611224, Example 1e
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cc(Br)ccc2OC)C1=O
|
C22H26BrN3O3 460.372000 |
POIUOUBPRXVQRQ-KSSFIOAISA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314261; PubChem:CID89923730
|
Local ready
Direct docking supported
|
|
E3L013946
BDB013946
|
US9611224, Example 1f
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cc(Cl)ccc2OC)C1=O
|
C22H26ClN3O3 415.921000 |
ZGSGSOZMWNPKFA-KSSFIOAISA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314262; PubChem:CID89923129
|
Local ready
Direct docking supported
|
|
E3L013947
BDB013947
|
US9611224, Example 1g
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cc(F)ccc2F)C1=O
|
C21H23F2N3O2 387.430000 |
DLDADEOCWIUAQP-UGSOOPFHSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314263; PubChem:CID89923329
|
Local ready
Direct docking supported
|
|
E3L013948
BDB013948
|
US9611224, Example 1h
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(F)c(F)c(F)c(F)c2F)C1=O
|
C21H20F5N3O2 441.400000 |
IZPIJFXCHRCIPC-GWCFXTLKSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314264; PubChem:CID89923278
|
Local ready
Direct docking supported
|
|
E3L013949
BDB013949
|
US9611224, Example 1i
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2ccc(Cl)cc2OC)C1=O
|
C22H26ClN3O3 415.921000 |
QOQODEARXXJVEJ-KSSFIOAISA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314265; PubChem:CID89923602
|
Local ready
Direct docking supported
|
|
E3L013950
BDB013950
|
US9611224, Example 1j
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2ccc(Br)cc2OC)C1=O
|
C22H26BrN3O3 460.372000 |
VRXPRDIKWYLFEV-KSSFIOAISA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314266; PubChem:CID89923523
|
Local ready
Direct docking supported
|
|
E3L013951
BDB013951
|
US9611224, Example 1k
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2noc3ccccc23)C1=O
|
C22H24N4O3 392.459000 |
GOTDRMBZGDNKHM-YOEHRIQHSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314267; PubChem:CID89922812
|
Local ready
Direct docking supported
|
|
E3L013952
BDB013952
|
US9611224, Example 1l
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cc(Cl)ccc2Cl)C1=O
|
C21H23Cl2N3O2 420.340000 |
ADGFKQHXHIXESD-UGSOOPFHSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314268; PubChem:CID89923061
|
Local ready
Direct docking supported
|
|
E3L013953
BDB013953
|
US9611224, Example 1m
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cc(Cl)ccc2F)C1=O
|
C21H23ClFN3O2 403.885000 |
ZOKFGCXAELTIIG-UGSOOPFHSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314269; PubChem:CID89922737
|
Local ready
Direct docking supported
|
|
E3L013954
BDB013954
|
US9611224, Example 1n
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cc(I)ccc2OC)C1=O
|
C22H26IN3O3 507.372000 |
NNOODPFOPSZHKW-KSSFIOAISA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314271; PubChem:CID89922548
|
Local ready
Direct docking supported
|
|
E3L013955
BDB013955
|
US9611224, Example 1o
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cc(C(C)C)ccc2OC)C1=O
|
C25H33N3O3 423.557000 |
NEKKQTSEFYYVBE-UWJYYQICSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314272; PubChem:CID89923035
|
Local ready
Direct docking supported
|
|
E3L013956
BDB013956
|
US9611224, Example 2b
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2ccsc2)C1=O
|
C19H23N3O2S 357.479000 |
BZTVXAHFKBWEBO-BBRMVZONSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314274; PubChem:CID89923707
|
Local ready
Direct docking supported
|
|
E3L013957
BDB013957
|
US9611224, Example 2c
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cncs2)C1=O
|
C18H22N4O2S 358.467000 |
KXTJAJNJUZIYLH-WFASDCNBSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314276; PubChem:CID89923747
|
Local ready
Direct docking supported
|
|
E3L013958
BDB013958
|
US9611224, Example 2d
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2nccs2)C1=O
|
C18H22N4O2S 358.467000 |
MARARTNNFBKKEQ-JSGCOSHPSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314277; PubChem:CID89923543
|
Local ready
Direct docking supported
|
|
E3L013959
BDB013959
|
US9611224, Example 2e
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cnco2)C1=O
|
C18H22N4O3 342.399000 |
CKRMVMQXRIVERD-WFASDCNBSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314278; PubChem:CID89923444
|
Local ready
Direct docking supported
|
|
E3L013960
BDB013960
|
US9611224, Example 2f
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2cccnc2)C1=O
|
C20H24N4O2 352.438000 |
KAZLKNUYWKUXMF-YOEHRIQHSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314279; PubChem:CID89923382
|
Local ready
Direct docking supported
|