| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L022301
BDB022301
|
US11161839, Example 10s
C[C@H](Nc1cc(=O)n(C)c2ccc(Nc3ccnc(Cl)c3C#N)cc12)c1ncccn1
|
C22H18ClN7O 431.887000 |
NZWNGZWURJFQPT-ZDUSSCGKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522298; PubChem:CID135385638
|
Local ready
Direct docking supported
|
|
E3L022302
BDB022302
|
US11161839, Example 10t
CC(Nc1cc(=O)n(C)c2ccc(Nc3ncnc(Cl)c3C#N)cc12)c1ncccn1
|
C21H17ClN8O 432.875000 |
NCXUWIDTOLXAQB-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522299; PubChem:CID135385888
|
Local ready
Direct docking supported
|
|
E3L022303
BDB022303
|
US11161839, Example 10u
Cn1c(=O)cc(NC2(c3ncccn3)CC2)c2cc(Nc3ccnc(Cl)c3C#N)ccc21
|
C23H18ClN7O 443.898000 |
IBHPKPXWIZWYIK-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522300; PubChem:CID135385689
|
Local ready
Direct docking supported
|
|
E3L022304
BDB022304
|
US11161839, Example 10v
CC(Nc1cc(=O)n(CC2CCCCC2)c2ccc(Nc3ccnc(Cl)c3C#N)cc12)c1ncccn1
|
C28H28ClN7O 514.033000 |
BHIWVDGBCNBFNA-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522301; PubChem:CID135385914
|
Local ready
Direct docking supported
|
|
E3L022305
BDB022305
|
US11161839, Example 10w
CC(Nc1cc(=O)n(C)c2ccc(Nc3ccnc(Cl)c3C#N)cc12)c1ncc(C2CCOCC2)cn1
|
C27H26ClN7O2 516.005000 |
DMBSYKQIRZILJQ-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522302; PubChem:CID135386116
|
Local ready
Direct docking supported
|
|
E3L022306
BDB022306
|
US11161839, Example 10x
CC(Nc1cc(=O)n(C)c2ccc(Nc3ccnc(Cl)c3C#N)cc12)c1ncc(N2CCOCC2)cn1
|
C26H25ClN8O2 516.993000 |
PNXOFIQWFGLARR-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522303; PubChem:CID156564910
|
Local ready
Direct docking supported
|
|
E3L022307
BDB022307
|
US11161839, Example 11a
Cn1c(=O)cc(N[C@H](CO)C2CC2)c2cc(Nc3ccnc(Cl)c3C#N)ccc21
|
C21H20ClN5O2 409.877000 |
FGMNFCHFVFDWOQ-GOSISDBHSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522304; PubChem:CID142478374
|
Local ready
Direct docking supported
|
|
E3L022308
BDB022308
|
US11161839, Example 11b
Cn1c(=O)cc(NC(C)(C)c2ccccn2)c2cc(Nc3ccnc(Cl)c3C#N)ccc21
|
C24H21ClN6O 444.926000 |
ZKGYAUDQUTWRQH-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522305; PubChem:CID135385326
|
Local ready
Direct docking supported
|
|
E3L022309
BDB022309
|
US11161839, Example 11c
Cn1cc(CNC(=O)C(C)(C)Nc2cc(=O)n(C)c3ccc(Nc4ccnc(Cl)c4C#N)cc23)cn1
|
C25H25ClN8O2 504.982000 |
HQNKBMOECWKVPA-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522306; PubChem:CID135385623
|
Local ready
Direct docking supported
|
|
E3L022310
BDB022310
|
US11161839, Example 11d
CC(Nc1cc(=O)n(C)c2ccc(Nc3ccnc(Cl)c3C#N)cc12)c1ccccn1
|
C23H19ClN6O 430.899000 |
PELMLHFTWVSBET-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522307; PubChem:CID135385330
|
Local ready
Direct docking supported
|
|
E3L022311
BDB022311
|
US11161839, Example 11e
COc1ncc(Cl)c(Nc2ccc3c(c2)c(N[C@H](C)C2CC2)cc(=O)n3C)n1
|
C20H22ClN5O2 399.882000 |
WFXJYELRSZIRPM-LLVKDONJSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522308; PubChem:CID142478241
|
Local ready
Direct docking supported
|
|
E3L022312
BDB022312
|
US11161839, Example 11f
COc1ncc(Cl)c(Nc2ccc3c(c2)c(N[C@H](CO)C2CC2)cc(=O)n3C)n1
|
C20H22ClN5O3 415.881000 |
NXWFJODBXYSTLT-MRXNPFEDSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522309; PubChem:CID142478240
|
Local ready
Direct docking supported
|
|
E3L022313
BDB022313
|
US11161839, Example 11g
COCCOCC(C)Nc1cc(=O)n(C)c2ccc(Nc3ccnc(Cl)c3C#N)cc12
|
C22H24ClN5O3 441.919000 |
MFTQJRMOHSGUIC-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522310; PubChem:CID135386554
|
Local ready
Direct docking supported
|
|
E3L022314
BDB022314
|
US11161839, Example 11h
CC(Nc1cc(=O)n(CC2CC2)c2ccc(Nc3ccnc(Cl)c3C#N)cc12)c1ncccn1
|
C25H22ClN7O 471.952000 |
MZFQLFIVAHTACB-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522311; PubChem:CID135385947
|
Local ready
Direct docking supported
|
|
E3L022315
BDB022315
|
US11161839, Example 11i
CC(Nc1cc(=O)n(CC2CCC2)c2ccc(Nc3ccnc(Cl)c3C#N)cc12)c1ncccn1
|
C26H24ClN7O 485.979000 |
YDNPPPHHDQJDAV-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522312; PubChem:CID135386079
|
Local ready
Direct docking supported
|
|
E3L022316
BDB022316
|
US11161839, Example 11j
CC(Nc1cc(=O)n(CCO)c2ccc(Nc3ccnc(Cl)c3C#N)cc12)c1ncccn1
|
C23H20ClN7O2 461.913000 |
OODWDCVBBUXXLT-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522313; PubChem:CID135385337
|
Local ready
Direct docking supported
|
|
E3L022317
BDB022317
|
US11161839, Example 12a
C[C@@H](Nc1cc(=O)n(C)c2ccc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc12)C1CC1
|
C27H34ClN7O2 524.069000 |
QPRQCCVADFXNHI-MRXNPFEDSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522314; PubChem:CID142478361
|
Local ready
Direct docking supported
|
|
E3L022318
BDB022318
|
US11161839, Example 12b
C[C@H](Nc1nc(=O)n(C)c2ccc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc12)C1CC1
|
C26H33ClN8O2 525.057000 |
PEIIHFMXMOKAMW-HNNXBMFYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522315; PubChem:CID162679695
|
Local ready
Direct docking supported
|
|
E3L022319
BDB022319
|
US11161839, Example 12c
COc1cc(Nc2nc(N3CCC(C(=O)N(C)C)CC3)ncc2Cl)cc2c(NC(C)(C)c3ncccn3)nc(=O)n(C)c12
|
C29H35ClN10O3 607.119000 |
FBKUCWHORXEJKA-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522316; PubChem:CID162679696
|
Local ready
Direct docking supported
|
|
E3L022320
BDB022320
|
US11161839, Example 12d
CC(Nc1nc(=O)n(C)c2ccc(Nc3nc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc12)c1ncccn1
|
C27H31ClN10O2 563.066000 |
SAZDNSOEQWGPKM-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522317; PubChem:CID135386703
|
Local ready
Direct docking supported
|