| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L022361
BDB022361
|
US11161839, Example 19d
COCC(C)(C)Nc1cc(=O)n(C)c2ccc(Nc3ccnc(Cl)c3C#N)cc12
|
C21H22ClN5O2 411.893000 |
MYWDAGVSLYNAQP-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522359; PubChem:CID135386801
|
Local ready
Direct docking supported
|
|
E3L022362
BDB022362
|
US11161839, Example 19e
CC(Nc1cc(=O)n(C)c2ccc(Nc3ncnc(Cl)c3Cl)cc12)c1ncccn1
|
C20H17Cl2N7O 442.310000 |
JVXMYBAIOOAYDX-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522360; PubChem:CID156564872
|
Local ready
Direct docking supported
|
|
E3L022363
BDB022363
|
US11161839, Example 19f
CCC(C)(COC)Nc1cc(=O)n(C)c2ccc(Nc3cc(C(=O)NC)nc(Cl)c3C#N)cc12
|
C24H27ClN6O3 482.972000 |
FNNGTIKNTVEBBA-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522361; PubChem:CID135386604
|
Local ready
Direct docking supported
|
|
E3L022364
BDB022364
|
US11161839, Example 19g
CNC(=O)c1cc(Nc2ccc3c(c2)c(N[C@H]2CCC[C@H]2OC)cc(=O)n3C)c(C#N)c(Cl)n1
|
C24H25ClN6O3 480.956000 |
GXHYQIIYKPTMQX-HRAATJIYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522362; PubChem:CID135385335
|
Local ready
Direct docking supported
|
|
E3L022365
BDB022365
|
US11161839, Example 19h
CC(Nc1cc(=O)n(C)c2ccc(Nc3ccnc(C#N)c3Cl)cc12)c1ncccn1
|
C22H18ClN7O 431.887000 |
YZEBCGPMOXAKAA-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522363; PubChem:CID135386106
|
Local ready
Direct docking supported
|
|
E3L022366
BDB022366
|
US11161839, Example 19i
Cn1c(=O)cc(NC2(c3ncccn3)CCOC2)c2cc(Nc3ccnc(Cl)c3C#N)ccc21
|
C24H20ClN7O2 473.924000 |
BKCBQBQZCOFFFA-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522364; PubChem:CID142478370
|
Local ready
Direct docking supported
|
|
E3L022367
BDB022367
|
US11161839, Example 20
CC(Nc1cc(=O)n(C)c2ccc(Nc3ccnc(Cl)c3C#N)cc12)c1ncc(-c2cccnc2)cn1
|
C27H21ClN8O 508.973000 |
NNRDVLIPZSCJMF-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522365; PubChem:CID135386249
|
Local ready
Direct docking supported
|
|
E3L022368
BDB022368
|
US11161839, Example 21
CC(=O)N(C)c1cc(Nc2ccc3c(c2)c(NC(C)c2ncccn2)cc(=O)n3C)c(Cl)cn1
|
C24H24ClN7O2 477.956000 |
AOXZYVGDHSPCFK-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522366; PubChem:CID135386094
|
Local ready
Direct docking supported
|
|
E3L022369
BDB022369
|
US11161839, Example 22a
CO[C@@H]1CC[C@H]1Nc1cc(=O)n(C)c2ccc(Nc3ccnc(Cl)c3C#N)cc12
|
C21H20ClN5O2 409.877000 |
PWPQABYRKAJTPI-VQIMIIECSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522367; PubChem:CID135386593
|
Local ready
Direct docking supported
|
|
E3L022370
BDB022370
|
US11161839, Example 22b
CO[C@H]1CC[C@H]1Nc1cc(=O)n(C)c2ccc(Nc3ccnc(Cl)c3C#N)cc12
|
C21H20ClN5O2 409.877000 |
PWPQABYRKAJTPI-APWZRJJASA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522368; PubChem:CID135385469
|
Local ready
Direct docking supported
|
|
E3L022371
BDB022371
|
US11161839, Example 23a
CNC(=O)c1cc(Nc2ccc3c(c2)c(NC2CCC2OC)cc(=O)n3C)c(C#N)c(Cl)n1
|
C23H23ClN6O3 466.929000 |
BAIZASZRQSZQOT-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522369; PubChem:CID142478341
|
Local ready
Direct docking supported
|
|
E3L022372
BDB022372
|
US11161839, Example 24a
CNC(=O)c1cc(Nc2ccc3c(c2)c(NC2(C#N)CC2)cc(=O)n3C)c(C#N)c(Cl)n1
|
C22H18ClN7O2 447.886000 |
VWKPHENVTAVFNH-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522371; PubChem:CID135387044
|
Local ready
Direct docking supported
|
|
E3L022373
BDB022373
|
US11161839, Example 24b
Cn1c(=O)cc(NC2(C#N)CC2)c2cc(Nc3ccnc(Cl)c3C#N)ccc21
|
C20H15ClN6O 390.834000 |
ROTINCDADLMAOE-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522372; PubChem:CID135386675
|
Local ready
Direct docking supported
|
|
E3L022374
BDB022374
|
US11161839, Example 24c
CCC(C)(Nc1cc(=O)n(C)c2ccc(Nc3ccnc(Cl)c3C#N)cc12)c1ncccn1
|
C24H22ClN7O 459.941000 |
CNFUQSGQCGXQFK-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522373; PubChem:CID135386680
|
Local ready
Direct docking supported
|
|
E3L022375
BDB022375
|
US11161839, Example 24d
C[C@@H](Nc1cc(=O)n(C)c2ncc(Nc3ccnc(Cl)c3C#N)cc12)C1CC1
|
C20H19ClN6O 394.866000 |
FJOHXRRCUZYIGM-LLVKDONJSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522374; PubChem:CID135386733
|
Local ready
Direct docking supported
|
|
E3L022376
BDB022376
|
US11161839, Example 24e
CC(Nc1cc(=O)n(C)c2ccc(Nc3ccnc(Cl)c3C#N)cc12)c1cc2ccccc2cn1
|
C27H21ClN6O 480.959000 |
ZMIKJPOMGIVITO-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522375; PubChem:CID135385341
|
Local ready
Direct docking supported
|
|
E3L022377
BDB022377
|
US11161839, Example 24f
CC(Nc1cc(=O)n(C)c2ccc(Nc3ccnc(Cl)c3C#N)cc12)c1ncc(C2CCC2)cn1
|
C26H24ClN7O 485.979000 |
BKZWGJGVHHSHJJ-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522376; PubChem:CID135386679
|
Local ready
Direct docking supported
|
|
E3L022378
BDB022378
|
US11161839, Example 25a
C[C@@H]1CN(c2ncc(Cl)c(Nc3ccc4c(c3)c(NC(C)(C)c3ncccn3)nc(=O)n4C)n2)C[C@H](C)C1(F)F
|
C27H30ClF2N9O 570.048000 |
VFZCYSUMYUKYSK-IYBDPMFKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522377; PubChem:CID142478235
|
Local ready
Direct docking supported
|
|
E3L022379
BDB022379
|
US11161839, Example 26a
C[C@@H](Nc1cc(=O)n(C)c2ccc(Nc3nc(N4CCC4)ncc3Cl)cc12)C1CC1
|
C22H25ClN6O 424.936000 |
USPLDYXAJSKYFL-CYBMUJFWSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522378; PubChem:CID142478454
|
Local ready
Direct docking supported
|
|
E3L022380
BDB022380
|
US11161839, Example 26b
COCC1CCN1c1ncc(Cl)c(Nc2ccc3c(c2)c(N[C@H](C)C2CC2)cc(=O)n3C)n1
|
C24H29ClN6O2 468.989000 |
AFTZZQPFZRHDDN-XPCCGILXSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522379; PubChem:CID142478397
|
Local ready
Direct docking supported
|