| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L013881
BDB013881
|
BDBM314193
CC[C@H](N)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C26H28BrN3O3 510.432000 |
IBJOBNCEBJHXSH-VXKWHMMOSA-N | Q13490 | Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314193; PubChem:CID72949812
|
Local ready
Direct docking supported
|
|
E3L013882
BDB013882
|
US9611224, Example 6
CC[C@H](NCCO)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C28H32BrN3O4 554.485000 |
RNTZHJJEVWBPMP-ZEQRLZLVSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314194; PubChem:CID72709735
|
Local ready
Direct docking supported
|
|
E3L013883
BDB013883
|
US9611224, Example 7
CC[C@H](NC1CCC1)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C30H34BrN3O3 564.524000 |
HZMPRWJPRPXPDB-UIOOFZCWSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314195; PubChem:CID72949982
|
Local ready
Direct docking supported
|
|
E3L013884
BDB013884
|
US9611224, Example 8
CC[C@H](NCc1ccccc1)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C33H34BrN3O3 600.557000 |
XZVATXQCSUAWEK-VMPREFPWSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314196; PubChem:CID72949983
|
Local ready
Direct docking supported
|
|
E3L013885
BDB013885
|
US9611224, Example 9
CC[C@H](NC1COC1)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C29H32BrN3O4 566.496000 |
XGUKDOMPJLTLHN-DQEYMECFSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314197; PubChem:CID72949984
|
Local ready
Direct docking supported
|
|
E3L013886
BDB013886
|
US9611224, Example 11
COc1ccc2cc(Br)ccc2c1CN1C(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)CCc2ccccc21
|
C26H28BrN3O4 526.431000 |
YRFALZLFBOWGKJ-SJODRWRQSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314199; PubChem:CID72949986
|
Local ready
Direct docking supported
|
|
E3L013887
BDB013887
|
US9611224, Example 12
COc1ccc2cc(Br)ccc2c1CN1C(=O)[C@@H](NC(=O)[C@@H](N)CO)CCc2ccccc21
|
C25H26BrN3O4 512.404000 |
SWLQXVBDEADDDI-SFTDATJTSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314200; PubChem:CID72949988
|
Local ready
Direct docking supported
|
|
E3L013888
BDB013888
|
US9611224, Example 13
COc1ccc2cc(Br)ccc2c1CN1C(=O)[C@@H](NC(=O)[C@@H](N)C2CC2)CCc2ccccc21
|
C27H28BrN3O3 522.443000 |
JIFFXYGVAOFBEN-DHLKQENFSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314201; PubChem:CID89932602
|
Local ready
Direct docking supported
|
|
E3L013889
BDB013889
|
US9611224, Example 14
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(C#CC3(O)COC3)ccc3ccccc23)C1=O
|
C30H31N3O4 497.595000 |
ZPOOJWQSCLPBNX-FNZWTVRRSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314202; PubChem:CID72950155
|
Local ready
Direct docking supported
|
|
E3L013890
BDB013890
|
US9611224, Example 15
CCCOc1ccc2ccccc2c1CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)CCc2ccccc21
|
C28H33N3O3 459.590000 |
HOGBKQQBNHLBJZ-CYFREDJKSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314203; PubChem:CID72950157
|
Local ready
Direct docking supported
|
|
E3L013891
BDB013891
|
US9611224, Example 16
C=CCOc1ccc2ccccc2c1CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)CCc2ccccc21
|
C28H31N3O3 457.574000 |
ATKMUXXTPWSUOH-CYFREDJKSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314204; PubChem:CID72950158
|
Local ready
Direct docking supported
|
|
E3L013892
BDB013892
|
US9611224, Example 17
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(O)ccc3ccccc23)C1=O
|
C25H27N3O3 417.509000 |
FWFHGNRIWVYPES-KKSFZXQISA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314205; PubChem:CID72950160
|
Local ready
Direct docking supported
|
|
E3L013893
BDB013893
|
US9611224, Example 18
CN[C@@H](C)C(=O)N[C@H]1CCc2ccc(OCc3ccccc3)cc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C33H35N3O3 521.661000 |
GZRCWBNDVFZTQF-JHOBJCJYSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314206; PubChem:CID72950318
|
Local ready
Direct docking supported
|
|
E3L013894
BDB013894
|
US9611224, Example 19
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2csc3ccc(Br)cc23)C1=O
|
C23H24BrN3O2S 486.435000 |
AHQKJQMCITWCEP-LIRRHRJNSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314207; PubChem:CID89922834
|
Local ready
Direct docking supported
|
|
E3L013895
BDB013895
|
US9611224, Example 20
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2csc3ccccc23)C1=O
|
C23H25N3O2S 407.539000 |
VYQZYMYLLIFSBA-KXBFYZLASA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314208; PubChem:CID89923466
|
Local ready
Direct docking supported
|
|
E3L013896
BDB013896
|
US9611224, Example 21
CN[C@@H](C)C(=O)N[C@H]1CCc2ccc(-c3ccccc3)cc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C32H33N3O2 491.635000 |
ZBHQMUADNQRXDJ-ZTOMLWHTSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM314209; PubChem:CID72950320
|
Local ready
Direct docking supported
|
|
E3L013897
BDB013897
|
US9611224, Example 22
CN[C@@H](C)C(=O)N[C@H]1CCc2ccc(OCc3ccccc3)cc2N(Cc2ccccc2)C1=O
|
C28H31N3O3 457.574000 |
NYQMQADRWJYBPG-CPJSRVTESA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314210; PubChem:CID89923393
|
Local ready
Direct docking supported
|
|
E3L013898
BDB013898
|
US9611224, Example 23
CN[C@@H](C)C(=O)N[C@H]1CCc2ccc(OCCc3ccccc3)cc2N(Cc2ccccc2)C1=O
|
C29H33N3O3 471.601000 |
OOEPPEBTTWMPAL-LVXARBLLSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314211; PubChem:CID89922415
|
Local ready
Direct docking supported
|
|
E3L013899
BDB013899
|
US9611224, Example 24
CN[C@@H](C)C(=O)N[C@H]1CCc2ccc(OC)cc2N(Cc2ccccc2)C1=O
|
C22H27N3O3 381.476000 |
LUJCBWKLURNDLX-KXBFYZLASA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314212; PubChem:CID89923196
|
Local ready
Direct docking supported
|
|
E3L013900
BDB013900
|
US9611224, Example 25
CN[C@@H](C)C(=O)N[C@H]1CCc2ccc(OCCCc3ccccc3)cc2N(Cc2ccccc2)C1=O
|
C30H35N3O3 485.628000 |
ZPLHGAQDVCJUTB-CUNXSJBXSA-N | Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM314213; PubChem:CID89923208
|
Local ready
Direct docking supported
|