| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L006001
BDB006001
|
BDBM139056
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)Nc2ccc(NC(=O)N3CC[C@H]4CC[C@@H](C(=O)NC(c5ccccc5)c5ccccc5)N4C(=O)[C@@H](NC(=O)[C@H](C)NC)C3)cc2)CC[C@H]2CCC(C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O
|
C62H74N12O8 1115.350000 |
SGWUDLNUDPDRSR-MUVXGTAXSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM139056
|
Local ready
Direct docking supported
|
|
E3L006002
BDB006002
|
BDBM139057
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)NCc2cccc(CNC(=O)N3CC[C@H]4CC[C@@H](C(=O)NC(c5ccccc5)c5ccccc5)N4C(=O)[C@@H](NC(=O)[C@H](C)NC)C3)c2)CC[C@H]2CCC(C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O
|
C64H78N12O8 1143.404000 |
ISELJTJQCKSQCK-SGPRFTBASA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM139057
|
Local ready
Direct docking supported
|
|
E3L006003
BDB006003
|
BDBM139058
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)NCCCCCCCCNC(=O)N2CC[C@H]3CC[C@@H](C(=O)N[C@@H]4CCCc5ccccc54)N3C(=O)[C@@H](NC(=O)[C@H](C)NC)C2)CC[C@H]2CCC(C(=O)N[C@@H]3CCCc4ccccc43)N2C1=O
|
C58H86N12O8 1079.402000 |
QRNCIGWSIMDYBM-VXUVBMGISA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM139058
|
Local ready
Direct docking supported
|
|
E3L006004
BDB006004
|
BDBM139059
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)Nc2ccc(NC(=O)N3CC[C@H]4CC[C@@H](C(=O)N[C@@H]5CCCc6ccccc65)N4C(=O)[C@@H](NC(=O)[C@H](C)NC)C3)cc2)CC[C@H]2CCC(C(=O)N[C@@H]3CCCc4ccccc43)N2C1=O
|
C56H74N12O8 1043.284000 |
AOPVVJOCCHZNCN-QCRIRGPOSA-N | P98170, Q13489, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB
BindingDB:BDBM139059
|
Local ready
Direct docking supported
|
|
E3L006005
BDB006005
|
BDBM139060
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)NCc2cccc(CNC(=O)N3CC[C@H]4CC[C@@H](C(=O)N[C@@H]5CCCc6ccccc65)N4C(=O)[C@@H](NC(=O)[C@H](C)NC)C3)c2)CC[C@H]2CCC(C(=O)N[C@@H]3CCCc4ccccc43)N2C1=O
|
C58H78N12O8 1071.338000 |
KLYXDCOHIFSNJD-PYUVMZPRSA-N | P98170, Q13489, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB
BindingDB:BDBM139060
|
Local ready
Direct docking supported
|
|
E3L006006
BDB006006
|
BDBM139061
CN[C@@H](C)C(=O)N[C@H]1CN(S(=O)(=O)CC/C=C/CCS(=O)(=O)N2CC[C@H]3CC[C@@H](C(=O)NC(c4ccccc4)c4ccccc4)N3C(=O)[C@@H](NC(=O)[C@H](C)NC)C2)CC[C@H]2CCC(C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O
|
C60H78N10O10S2 1163.478000 |
PRFHCKHNJWWIFM-BMCVGCHGSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB
BindingDB:BDBM139061
|
Local ready
Direct docking supported
|
|
E3L006007
BDB006007
|
BDBM139062
CN[C@@H](C)C(=O)N[C@H]1CN(S(=O)(=O)CCC/C=C/CCCS(=O)(=O)N2CC[C@H]3CC[C@@H](C(=O)NC(c4ccccc4)c4ccccc4)N3C(=O)[C@@H](NC(=O)[C@H](C)NC)C2)CC[C@H]2CCC(C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O
|
C62H82N10O10S2 1191.532000 |
IOFHGBCWNJUHDC-QQMIVZMLSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM139062
|
Local ready
Direct docking supported
|
|
E3L006008
BDB006008
|
BDBM139063
CN[C@@H](C)C(=O)N[C@H]1CN(S(=O)(=O)CCCCCCS(=O)(=O)N2CC[C@H]3CC[C@@H](C(=O)NC(c4ccccc4)c4ccccc4)N3C(=O)[C@@H](NC(=O)[C@H](C)NC)C2)CC[C@H]2CCC(C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O
|
C60H80N10O10S2 1165.494000 |
SJTAOGPAGKLGJU-VWEWNJDNSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM139063
|
Local ready
Direct docking supported
|
|
E3L006009
BDB006009
|
BDBM139064
CN[C@@H](C)C(=O)N[C@H]1CN(S(=O)(=O)CCCCCCCCS(=O)(=O)N2CC[C@H]3CC[C@@H](C(=O)NC(c4ccccc4)c4ccccc4)N3C(=O)[C@@H](NC(=O)[C@H](C)NC)C2)CC[C@H]2CCC(C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O
|
C62H84N10O10S2 1193.548000 |
SUUFHAIKNRCHDE-IICSQRIHSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM139064
|
Local ready
Direct docking supported
|
|
E3L006010
BDB006010
|
BDBM139065
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)Nc2ccc(Cc3ccc(NC(=O)N4CC[C@H]5CC[C@@H](C(=O)NC(c6ccccc6)c6ccccc6)N5C(=O)[C@@H](NC(=O)[C@H](C)NC)C4)cc3)cc2)CC[C@H]2CCC(C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O
|
C69H80N12O8 1205.475000 |
DHBOEJJPDGNOTI-BICFXTAOSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM139065
|
Local ready
Direct docking supported
|
|
E3L006011
BDB006011
|
BDBM139066
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)Nc2ccc(Cc3ccc(NC(=O)N4CC[C@H]5CC[C@@H](C(=O)N[C@@H]6CCCc7ccccc76)N5C(=O)[C@@H](NC(=O)[C@H](C)NC)C4)cc3)cc2)CC[C@H]2CCC(C(=O)N[C@@H]3CCCc4ccccc43)N2C1=O
|
C63H80N12O8 1133.409000 |
RGGJVNBMMNQZIB-YWCAJDHESA-N | P98170, Q13489, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB
BindingDB:BDBM139066
|
Local ready
Direct docking supported
|
|
E3L006012
BDB006012
|
BDBM139067
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)NCCCCCCNC(=O)N2CC[C@H]3CC[C@@H](C(=O)NC(c4ccccc4)c4ccccc4)N3C(=O)[C@@H](NC(=O)[C@H](C)NC)C2)CC[C@H]2CCC(C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O
|
C62H82N12O8 1123.414000 |
SOXSKVJJMCLCDI-VWEWNJDNSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM139067
|
Local ready
Direct docking supported
|
|
E3L006013
BDB006013
|
BDBM139068
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)Nc2cccc(NC(=O)N3CC[C@H]4CC[C@@H](C(=O)NC(c5ccccc5)c5ccccc5)N4C(=O)[C@@H](NC(=O)[C@H](C)NC)C3)c2)CC[C@H]2CCC(C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O
|
C62H74N12O8 1115.350000 |
LOYSOJNWDYWXHG-MUVXGTAXSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM139068
|
Local ready
Direct docking supported
|
|
E3L006014
BDB006014
|
BDBM139069
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)Nc2ccc(Oc3ccc(NC(=O)N4CC[C@H]5CC[C@@H](C(=O)NC(c6ccccc6)c6ccccc6)N5C(=O)[C@@H](NC(=O)[C@H](C)NC)C4)cc3)cc2)CC[C@H]2CCC(C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O
|
C68H78N12O9 1207.447000 |
WQKJLURQKWFJSF-HXQIYBMDSA-N | P98170, Q13489, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB
BindingDB:BDBM139069
|
Local ready
Direct docking supported
|
|
E3L006015
BDB006015
|
BDBM139070
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)Nc2ccc(-c3ccc(NC(=O)N4CC[C@H]5CC[C@@H](C(=O)NC(c6ccccc6)c6ccccc6)N5C(=O)[C@@H](NC(=O)[C@H](C)NC)C4)c(C)c3)cc2C)CC[C@H]2CCC(C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O
|
C70H82N12O8 1219.502000 |
KLPSFLKKWHHGGJ-KJASOUKJSA-N | P98170, Q13489, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 |
BindingDB
BindingDB:BDBM139070
|
Local ready
Direct docking supported
|
|
E3L006016
BDB006016
|
BDBM139071
CN[C@@H](C)C(=O)N[C@H]1CN(C(=S)Nc2ccc(NC(=S)N3CC[C@H]4CC[C@@H](C(=O)NC(c5ccccc5)c5ccccc5)N4C(=O)[C@@H](NC(=O)[C@H](C)NC)C3)cc2)CC[C@H]2CCC(C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O
|
C62H74N12O6S2 1147.486000 |
KVLFGLKTXHRDEE-MUVXGTAXSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB
BindingDB:BDBM139071
|
Local ready
Direct docking supported
|
|
E3L006017
BDB006017
|
BDBM139072
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)Nc2ccc(CCc3ccc(NC(=O)N4CC[C@H]5CC[C@@H](C(=O)NC(c6ccccc6)c6ccccc6)N5C(=O)[C@@H](NC(=O)[C@H](C)NC)C4)cc3)cc2)CC[C@H]2CCC(C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O
|
C70H82N12O8 1219.502000 |
XZDUYCPLOANNJY-QCDGKUOLSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB
BindingDB:BDBM139072
|
Local ready
Direct docking supported
|
|
E3L006018
BDB006018
|
BDBM139073
CN[C@@H](C)C(=O)N[C@H]1CN(C(=S)Nc2ccc(Cc3ccc(NC(=S)N4CC[C@H]5CC[C@@H](C(=O)NC(c6ccccc6)c6ccccc6)N5C(=O)[C@@H](NC(=O)[C@H](C)NC)C4)cc3)cc2)CC[C@H]2CCC(C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O
|
C69H80N12O6S2 1237.611000 |
VRKMQFHUTBZCMK-BICFXTAOSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM139073
|
Local ready
Direct docking supported
|
|
E3L006019
BDB006019
|
BDBM139074
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)Nc2ccc(Sc3ccc(NC(=O)N4CC[C@H]5CC[C@@H](C(=O)NC(c6ccccc6)c6ccccc6)N5C(=O)[C@@H](NC(=O)[C@H](C)NC)C4)cc3)cc2)CC[C@H]2CCC(C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O
|
C68H78N12O8S 1223.515000 |
RGGYRNRJCZCWRE-HXQIYBMDSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM139074
|
Local ready
Direct docking supported
|
|
E3L006020
BDB006020
|
BDBM139075
CNCC(=O)N[C@H]1CN(C(=O)N2CCN(C(=O)N3CC[C@H]4CC[C@@H](C(=O)NC(c5ccccc5)c5ccccc5)N4C(=O)[C@@H](NC(=O)[C@H](C)NC)C3)CC2)CC[C@H]2CCC(C(=O)NC(c3ccccc3)c3ccccc3)N2C1=O
|
C59H74N12O8 1079.317000 |
DMOGSZBPFNPTJA-QCXOHWDJSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM139075
|
Local ready
Direct docking supported
|