| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L008721
BDB008721
|
BDBM213317
C[C@@H](Nc1nc(C(=O)O)nc2nc(-c3cc(C(F)F)cc(C(F)F)n3)n(Cc3ccc(C(F)(F)F)cc3)c12)C1CCC1
|
C27H23F7N6O2 596.507000 |
JSVWFDJUTFILPU-GFCCVEGCSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM213317; PubChem:CID77846871
|
Local ready
Direct docking supported
|
|
E3L008722
BDB008722
|
BDBM213323
C[C@@H](Nc1nc(C(=O)O)nc2nc(-c3ccc(C4OCCO4)cn3)n(Cc3ccc(C(F)(F)F)cc3)c12)C1CCC1
|
C28H27F3N6O4 568.556000 |
MWNHHTUADJJNBK-OAHLLOKOSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM213323; PubChem:CID77846956
|
Local ready
Direct docking supported
|
|
E3L008723
BDB008723
|
BDBM213352
C[C@@H](Nc1nc(C(=O)O)nc2nc(-c3ccc(OC(F)F)cn3)n(Cc3ccc(C(F)(F)F)cc3)c12)C1CCC1
|
C26H23F5N6O3 562.499000 |
DDQIFTQFWYJKKR-CYBMUJFWSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM213352; PubChem:CID77846957
|
Local ready
Direct docking supported
|
|
E3L008724
BDB008724
|
BDBM213354
COc1ccnc(-c2nc3nc(C(=O)O)nc(N[C@H](C)C4CCC4)c3n2Cc2ccc(C(F)(F)F)cc2)c1
|
C26H25F3N6O3 526.519000 |
ITRHKUPFILOEQW-CQSZACIVSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM213354; PubChem:CID77846958
|
Local ready
Direct docking supported
|
|
E3L008725
BDB008725
|
BDBM213358
CCCc1ccnc(-c2nc3nc(C(=O)O)nc(N[C@H](C)C4CCC4)c3n2Cc2ccc(C(F)(F)F)cc2)c1
|
C28H29F3N6O2 538.574000 |
VFDDIWFTWCMGIS-MRXNPFEDSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM213358; PubChem:CID77846959
|
Local ready
Direct docking supported
|
|
E3L008726
BDB008726
|
BDBM213359
CCc1ccnc(-c2nc3nc(C(=O)O)nc(N[C@H](C)C4CCC4)c3n2Cc2ccc(C(F)(F)F)cc2)c1
|
C27H27F3N6O2 524.547000 |
KLIDEBVNJPATCD-OAHLLOKOSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM213359; PubChem:CID77846960
|
Local ready
Direct docking supported
|
|
E3L008727
BDB008727
|
BDBM213361
CC(C)c1cccc(-c2nc3nc(C(=O)O)nc(N[C@H](C)C4CCC4)c3n2Cc2ccc(C(F)(F)F)cc2)n1
|
C28H29F3N6O2 538.574000 |
QNQAYWUSHPQEOB-MRXNPFEDSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM213361; PubChem:CID77847040
|
Local ready
Direct docking supported
|
|
E3L008728
BDB008728
|
BDBM213362
CC(C)c1ccnc(-c2nc3nc(C(=O)O)nc(N[C@H](C)C4CCC4)c3n2Cc2ccc(OC(F)(F)F)c(F)c2)c1
|
C28H28F4N6O3 572.563000 |
LNMKUQHCQKKGKH-OAHLLOKOSA-N | Q00987 | E3 ubiquitin-protein ligase Mdm2 |
BindingDB, PubChem
BindingDB:BDBM213362; PubChem:CID77847041
|
Local ready
Direct docking supported
|
|
E3L008729
BDB008729
|
BDBM213366
CN[C@H](C)C(=O)Nc1cc(-c2ncnc3c(C)nn(C)c23)cc(C#Cc2ccc3c(cnn3C)c2)n1
|
C26H25N9O 479.548000 |
LMNLBOFXCQQZHK-MRXNPFEDSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM213366; PubChem:CID124201767
|
Local ready
Direct docking supported
|
|
E3L008730
BDB008730
|
BDBM213367
CN[C@H](C)C(=O)Nc1cc(-c2ncnc3c(C)nn(C)c23)cc(C#Cc2ccc3c(C)nccc3c2)n1
|
C28H26N8O 490.571000 |
BFJRQYOXKDJOAD-GOSISDBHSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM213367; PubChem:CID124201768
|
Local ready
Direct docking supported
|
|
E3L008731
BDB008731
|
BDBM213368
CN[C@H](C)C(=O)Nc1cc(-c2ncnc3c(C)nn(C)c23)cc(C#Cc2cc(C)nc3c(F)cccc23)n1
|
C28H25FN8O 508.561000 |
HVHRROJQIZQHJX-QGZVFWFLSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM213368; PubChem:CID124201769
|
Local ready
Direct docking supported
|
|
E3L008732
BDB008732
|
BDBM213369
CN[C@H](C)C(=O)Nc1cc(-c2ncnc3c(C)nn(C)c23)cc(C#Cc2ccn3c(C)ncc3c2)n1
|
C26H25N9O 479.548000 |
ZHJDTJNSIZPBCQ-MRXNPFEDSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM213369; PubChem:CID124201770
|
Local ready
Direct docking supported
|
|
E3L008733
BDB008733
|
BDBM213370
CN[C@H](C)C(=O)Nc1cc(-c2c(OC)ccc3nc(C)ccc23)cc(C#Cc2ccccc2)n1
|
C28H26N4O2 450.542000 |
KRWDYMJZMRNHCX-LJQANCHMSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM213370; PubChem:CID124201771
|
Local ready
Direct docking supported
|
|
E3L008734
BDB008734
|
BDBM213371
CN[C@H](C)C(=O)Nc1cc(-c2ncnc3cnn(C)c23)cc(C#Cc2ccc3c(C)nccc3c2)n1
|
C27H24N8O 476.544000 |
AFNPHJOFGDZGGL-QGZVFWFLSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM213371; PubChem:CID124201772
|
Local ready
Direct docking supported
|
|
E3L008735
BDB008735
|
BDBM213372
CN[C@H](C)C(=O)Nc1cc(-c2ncnc3cnn(C)c23)cc(C#Cc2ccccc2)n1
|
C23H21N7O 411.469000 |
YBZIUCCRKJMKFE-OAHLLOKOSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM213372; PubChem:CID124201773
|
Local ready
Direct docking supported
|
|
E3L008736
BDB008736
|
BDBM213373
CN[C@H](C)C(=O)Nc1cc(-c2ncnc3cnn(C)c23)cc(C#Cc2ccc3c(ccc(=O)n3C)c2)n1
|
C27H24N8O2 492.543000 |
NICRIMMNOCVZDK-MRXNPFEDSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM213373; PubChem:CID124201774
|
Local ready
Direct docking supported
|
|
E3L008737
BDB008737
|
BDBM213374
CN[C@H](C)C(=O)Nc1cc(-c2ncnc3cnn(C)c23)cc(C#Cc2ccc(-n3cnc(C)c3)cc2)n1
|
C27H25N9O 491.559000 |
MGNFGDSTJAIDEC-GOSISDBHSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM213374; PubChem:CID124201775
|
Local ready
Direct docking supported
|
|
E3L008738
BDB008738
|
BDBM213375
CN[C@H](C)C(=O)Nc1cc(-c2ncnc3oc(C)c(C)c23)cc(C#Cc2ccccc2)n1
|
C25H23N5O2 425.492000 |
KKAHHENNYGUCJF-MRXNPFEDSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM213375; PubChem:CID124201776
|
Local ready
Direct docking supported
|
|
E3L008739
BDB008739
|
BDBM213376
CN[C@H](C)C(=O)Nc1cc(-c2cccc3nc(C)c(C)n23)cc(C#Cc2ccc3c(C)nccc3c2)n1
|
C30H28N6O 488.595000 |
YSWMEDPQKFWVOU-HXUWFJFHSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM213376; PubChem:CID124201777
|
Local ready
Direct docking supported
|
|
E3L008740
BDB008740
|
BDBM213377
CN[C@H](C)C(=O)Nc1cc(-c2cccc3cnn(C)c23)cc(C#Cc2ccc3c(c2)CC(=O)N3C)n1
|
C28H26N6O2 478.556000 |
VIAJWVFURJEYIO-QGZVFWFLSA-N | P98170, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM213377; PubChem:CID124201778
|
Local ready
Direct docking supported
|