| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L012001
BDB012001
|
BDBM243168
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(C(C)=O)cc2)c2ccccc2N(Cc2c(OC)ccc3ccccc23)C1=O
|
C34H34N4O5 578.669000 |
FXHJEMSCMLSORJ-KMRXNPHXSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM243168; PubChem:CID118077263
|
Local ready
Direct docking supported
|
|
E3L012002
BDB012002
|
BDBM243169
CC(=O)c1ccc(C(=O)N2C[C@H](NC(=O)[C@H](C)N)C(=O)N(Cc3c(OCC(F)(F)F)ccc4ccccc34)c3ccccc32)cc1
|
C34H31F3N4O5 632.639000 |
PCLCZNAVFJDVBZ-DCFHFQCYSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM243169; PubChem:CID118076800
|
Local ready
Direct docking supported
|
|
E3L012003
BDB012003
|
BDBM243170
CC(=O)c1ccc(C(=O)N2C[C@H](NC(=O)[C@H](C)N)C(=O)N(Cc3c(OC(F)F)ccc4ccccc34)c3ccccc32)cc1
|
C33H30F2N4O5 600.622000 |
RDBLJXAPGCYLSN-SIBVEZHUSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM243170; PubChem:CID118077356
|
Local ready
Direct docking supported
|
|
E3L012004
BDB012004
|
BDBM243171
COc1ccc2c(CN3C(=O)[C@@H](NC(=O)[C@H](C)N)CN(C(=O)c4ccc(C(C)=O)cc4)c4ccccc43)cc(=O)oc2c1
|
C32H30N4O7 582.613000 |
HVVSZNGOPOXPIZ-BVZFJXPGSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM243171; PubChem:CID118076759
|
Local ready
Direct docking supported
|
|
E3L012005
BDB012005
|
BDBM243172
CC(=O)c1ccc(C(=O)N2C[C@H](NC(=O)[C@H](C)N)C(=O)N(Cc3noc4ccccc34)c3ccccc32)cc1
|
C29H27N5O5 525.565000 |
BAOXXIQWSSOARZ-SBUREZEXSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM243172; PubChem:CID118076682
|
Local ready
Direct docking supported
|
|
E3L012006
BDB012006
|
BDBM243177
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccno2)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C29H28BrN5O5 606.477000 |
SZQOWYNAFZTCMS-JTSKRJEESA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM243177; PubChem:CID118077244
|
Local ready
Direct docking supported
|
|
E3L012007
BDB012007
|
BDBM243181
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(NC(C)=O)cc2)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C34H34BrN5O5 672.580000 |
LZVAKEDICCBHKT-MMTVBGGISA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM243181; PubChem:CID118077111
|
Local ready
Direct docking supported
|
|
E3L012008
BDB012008
|
BDBM243182
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccn(C)n2)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C30H31BrN6O4 619.520000 |
AEUZTKWFOPUNTM-UUOWRZLLSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM243182; PubChem:CID118077064
|
Local ready
Direct docking supported
|
|
E3L012009
BDB012009
|
BDBM243184
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)Cc2ccccn2)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C32H32BrN5O4 630.543000 |
FFVWHZRSFAVZOH-FNZWTVRRSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM243184; PubChem:CID118076562
|
Local ready
Direct docking supported
|
|
E3L012010
BDB012010
|
BDBM243185
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)Cc2ccc(Cl)nc2)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C32H31BrClN5O4 664.988000 |
HFZIOLXJKCBQDO-DFBJGRDBSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB
BindingDB:BDBM243185
|
Local ready
Direct docking supported
|
|
E3L012011
BDB012011
|
BDBM243186
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2cnn(C)c2)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C30H31BrN6O4 619.520000 |
XILMXZIFBUSEOU-UUOWRZLLSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM243186; PubChem:CID118077045
|
Local ready
Direct docking supported
|
|
E3L012012
BDB012012
|
BDBM243188
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2cccc(C#N)c2)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C33H30BrN5O4 640.538000 |
WBUFZQQQUGFIQL-DCFHFQCYSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM243188; PubChem:CID118076676
|
Local ready
Direct docking supported
|
|
E3L012013
BDB012013
|
BDBM243190
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)CCOC)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C29H33BrN4O5 597.510000 |
OSTWQFDDJBZQBY-MBSDFSHPSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM243190; PubChem:CID118076761
|
Local ready
Direct docking supported
|
|
E3L012014
BDB012014
|
BDBM243191
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccccc2C#N)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C33H30BrN5O4 640.538000 |
HDONNVBOHIVUBU-DCFHFQCYSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM243191; PubChem:CID118077067
|
Local ready
Direct docking supported
|
|
E3L012015
BDB012015
|
BDBM243194
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2)c2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C33H30BrF3N4O4 683.525000 |
ZKGFDAFPIRQCGA-SIBVEZHUSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM243194; PubChem:CID118077119
|
Local ready
Direct docking supported
|
|
E3L012016
BDB012016
|
BDBM243195
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)Cc2nnn[nH]2)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C28H30N8O3 526.601000 |
NIRXVIXPZGSIQY-AVRDEDQJSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM243195; PubChem:CID118077183
|
Local ready
Direct docking supported
|
|
E3L012017
BDB012017
|
BDBM243196
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)CC2CCOCC2)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C32H38N4O4 542.680000 |
FKPUSQNNSDNGBB-CUNXSJBXSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM243196; PubChem:CID118076528
|
Local ready
Direct docking supported
|
|
E3L012018
BDB012018
|
BDBM243197
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(C#N)cc2)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C33H31N5O3 545.643000 |
FWJQHHBSVNLJBA-DWACAAAGSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM243197; PubChem:CID118077170
|
Local ready
Direct docking supported
|
|
E3L012019
BDB012019
|
BDBM243198
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)CC2CCCCC2)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C33H40N4O3 540.708000 |
JWZHGQQKGZBONI-FIPFOOKPSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM243198; PubChem:CID118077049
|
Local ready
Direct docking supported
|
|
E3L012020
BDB012020
|
BDBM243199
CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(Cl)cc2)c2ccccc2N(Cc2c(C)ccc3ccccc23)C1=O
|
C32H31ClN4O3 555.078000 |
YXTJOFXWLBJVQR-IDISGSTGSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM243199; PubChem:CID118077336
|
Local ready
Direct docking supported
|