| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L056301
BDB056301
|
BDBM50440609
CCN1Cc2ccc(NC(=O)c3ccc(C(=O)N4CCC(N5CCCC5)CC4)cc3)cc2C1
|
C27H34N4O2 446.595000 |
WLYODYRGAADTOM-UHFFFAOYSA-N | P29375, Q96T88, Q9BUL5 | Lysine-specific demethylase 5A, PHD finger protein 23, E3 ubiquitin-protein ligase UHRF1 |
BindingDB, PubChem
BindingDB:BDBM50440609; PubChem:CID73333227
|
Local ready
Direct docking supported
|
|
E3L056302
BDB056302
|
BDBM50440610
O=C(c1ccc(C(=O)N2CCC(N3CCCC3)CC2)c(-c2ccccc2)c1)N1CCC(N2CCCC2)CC1
|
C32H42N4O2 514.714000 |
MDMZPCZMVQJPHJ-UHFFFAOYSA-N | P29375, Q96T88, Q9BUL5 | E3 ubiquitin-protein ligase UHRF1, PHD finger protein 23, Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50440610; PubChem:CID73333226
|
Local ready
Direct docking supported
|
|
E3L056303
BDB056303
|
BDBM50440611
O=C(c1ccc(C(=O)N2CCC(N3CCCC3)CC2)c(Oc2ccccc2)c1)N1CCC(N2CCCC2)CC1
|
C32H42N4O3 530.713000 |
ZLXWPCBVLILWIW-UHFFFAOYSA-N | P29375, Q96T88, Q9BUL5 | E3 ubiquitin-protein ligase UHRF1, PHD finger protein 23, Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM50440611; PubChem:CID73333225
|
Local ready
Direct docking supported
|
|
E3L056304
BDB056304
|
BDBM50440612
O=C(c1ccc(C(=O)N2CCC(N3CCCC3)CC2)c(Cc2ccccc2)c1)N1CCC(N2CCCC2)CC1
|
C33H44N4O2 528.741000 |
IQFNTVZARNOVIR-UHFFFAOYSA-N | P29375, Q96T88, Q9BUL5 | Lysine-specific demethylase 5A, PHD finger protein 23, E3 ubiquitin-protein ligase UHRF1 |
BindingDB, PubChem
BindingDB:BDBM50440612; PubChem:CID73333129
|
Local ready
Direct docking supported
|
|
E3L056305
BDB056305
|
BDBM50440613
O=C(c1ccc(C(=O)N2CCC(N3CCCC3)CC2)c(NCc2ccccc2)c1)N1CCC(N2CCCC2)CC1
|
C33H45N5O2 543.756000 |
OVRNYUBVMFXXBA-UHFFFAOYSA-N | P29375, Q96T88, Q9BUL5 | Lysine-specific demethylase 5A, E3 ubiquitin-protein ligase UHRF1, PHD finger protein 23 |
BindingDB, PubChem
BindingDB:BDBM50440613; PubChem:CID73333128
|
Local ready
Direct docking supported
|
|
E3L056306
BDB056306
|
Unc1215
O=C(c1ccc(C(=O)N2CCC(N3CCCC3)CC2)c(Nc2ccccc2)c1)N1CCC(N2CCCC2)CC1
|
C32H43N5O2 529.729000 |
PQOOIERVZAXHBP-UHFFFAOYSA-N | P29375, Q96T88, Q9BUL5 | E3 ubiquitin-protein ligase UHRF1, Lysine-specific demethylase 5A, PHD finger protein 23 |
BindingDB, PubChem
BindingDB:BDBM50440614; PubChem:CID57339144
|
Local ready
Direct docking supported
|
|
E3L056307
BDB056307
|
BDBM50441334
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(C#N)n(-c3ccccc3C#N)c3ccccc23)c2ccccc2OC12CCOCC2
|
C34H32N6O4 588.668000 |
CWXNEODDUDWHDU-WKRVVKTRSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441334; PubChem:CID72713171
|
Local ready
Direct docking supported
|
|
E3L056308
BDB056308
|
BDBM50441335
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2nn(-c3ccccc3C#N)c3ccccc23)c2ccccc2OC12CCOCC2
|
C32H32N6O4 564.646000 |
YDIPFRDEORVQAS-KCWXNJEJSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441335; PubChem:CID72713170
|
Local ready
Direct docking supported
|
|
E3L056309
BDB056309
|
BDBM50441336
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2noc3ccccc23)c2ccccc2OC12CCOCC2
|
C25H28N4O5 464.522000 |
RJNKRXWCPPRDRL-KSFYIVLOSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441336; PubChem:CID72713169
|
Local ready
Direct docking supported
|
|
E3L056310
BDB056310
|
BDBM50441337
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(OC)cnc3ccccc23)c2ccccc2OC12CCOCC2
|
C28H32N4O5 504.587000 |
PCTAPXHACYCSMY-AVRWGWEMSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441337; PubChem:CID72713167
|
Local ready
Direct docking supported
|
|
E3L056311
BDB056311
|
BDBM50441338
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(OC)ccc3cc(C(=O)O)ccc23)c2ccccc2OC12CCOCC2
|
C30H33N3O7 547.608000 |
PXBQMHIHZVFKSD-HFJWLAOPSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441338; PubChem:CID71819720
|
Local ready
Direct docking supported
|
|
E3L056312
BDB056312
|
BDBM50441339
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(OC(F)F)ccc3ccccc23)c2ccccc2OC12CCOCC2
|
C29H31F2N3O5 539.579000 |
GKZPMFPKQMBXTM-AVRWGWEMSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441339; PubChem:CID72712973
|
Local ready
Direct docking supported
|
|
E3L056313
BDB056313
|
BDBM50441340
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(C)ccc3ccccc23)c2ccccc2OC12CCOCC2
|
C29H33N3O4 487.600000 |
VXFXZFWOSDPFED-RXFWQSSRSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441340; PubChem:CID72712971
|
Local ready
Direct docking supported
|
|
E3L056314
BDB056314
|
BDBM50441341
CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(OC)ccc3cc(Br)ccc23)c2ccccc2OC12CCOCC2
|
C29H32BrN3O5 582.495000 |
VUTQKGLPLFESJM-HFJWLAOPSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441341; PubChem:CID72712969
|
Local ready
Direct docking supported
|
|
E3L056315
BDB056315
|
BDBM50441342
CN[C@@H](C)C(=O)N[C@H]1COc2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C25H26BrN3O4 512.404000 |
NYZLBAGNVDGXCG-YWZLYKJASA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441342; PubChem:CID72712771
|
Local ready
Direct docking supported
|
|
E3L056316
BDB056316
|
BDBM50441343
CCN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C27H30BrN3O3 524.459000 |
CSOXYPGEJYPUTB-SBUREZEXSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 2, E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3 |
BindingDB, PubChem
BindingDB:BDBM50441343; PubChem:CID72712769
|
Local ready
Direct docking supported
|
|
E3L056317
BDB056317
|
BDBM50441344
COc1ccc2cc(Br)ccc2c1CN1C(=O)[C@@H](NC(=O)[C@@H](N)[C@H](C)O)CCc2ccccc21
|
C26H28BrN3O4 526.431000 |
YRFALZLFBOWGKJ-WIRXAFICSA-N | P98170, Q13489, Q13490 | Baculoviral IAP repeat-containing protein 3, E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM50441344; PubChem:CID72712567
|
Local ready
Direct docking supported
|
|
E3L056318
BDB056318
|
BDBM50441345
CC[C@H](NC)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C27H30BrN3O3 524.459000 |
RYPWTORYCDZTOJ-GOTSBHOMSA-N | P98170 | E3 ubiquitin-protein ligase XIAP |
BindingDB, PubChem
BindingDB:BDBM50441345; PubChem:CID72712565
|
Local ready
Direct docking supported
|
|
E3L056319
BDB056319
|
BDBM50441346
CN[C@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C26H28BrN3O3 510.432000 |
PVSLHWGWLULYNF-ZHRRBRCNSA-N | P98170, Q13489, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 3, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM50441346; PubChem:CID72712563
|
Local ready
Direct docking supported
|
|
E3L056320
BDB056320
|
BDBM50441347
CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(OC)ccc3cc(Br)ccc23)C1=O
|
C26H28BrN3O3 510.432000 |
PVSLHWGWLULYNF-AOMKIAJQSA-N | P98170, Q13490 | E3 ubiquitin-protein ligase XIAP, Baculoviral IAP repeat-containing protein 2 |
BindingDB, PubChem
BindingDB:BDBM50441347; PubChem:CID72712561
|
Local ready
Direct docking supported
|