| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L022241
BDB022241
|
US11161839, Example 1v
CNC(=O)c1cc(Nc2ccc3c(c2)c(NC(C)c2ncccn2)cc(=O)n3C)c(C#N)c(Cl)n1
|
C24H21ClN8O2 488.939000 |
PMGSUHQRHRLLOM-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522238; PubChem:CID135385328
|
Local ready
Direct docking supported
|
|
E3L022242
BDB022242
|
US11161839, Example 5
CCNc1cc(=O)n(C)c2ccc(Nc3cc(C(=O)NC)nc(Cl)c3C#N)cc12
|
C20H19ClN6O2 410.865000 |
WKFDZDRXJLDYFN-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522239; PubChem:CID135385647
|
Local ready
Direct docking supported
|
|
E3L022243
BDB022243
|
US11161839, Example 1w
Cc1cc(Nc2ccc3c(c2)c(NC(C)c2ncccn2)cc(=O)n3C)c(C#N)c(Cl)n1
|
C23H20ClN7O 445.914000 |
YJCGJIHVIUDUTB-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522240; PubChem:CID135385794
|
Local ready
Direct docking supported
|
|
E3L022244
BDB022244
|
US11161839, Example 6a
CC(Nc1cc(=O)n(C)c2ccc(Nc3ccnc(Cl)c3Cl)cc12)c1ncccn1
|
C21H18Cl2N6O 441.322000 |
KMNHAPRNZMJUMB-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522241; PubChem:CID135385751
|
Local ready
Direct docking supported
|
|
E3L022245
BDB022245
|
US11161839, Example 1x
Cn1c(=O)cc(NC(C)(C)c2ncccn2)c2cc(Nc3ccnc(Cl)c3C#N)cnc21
|
C22H19ClN8O 446.902000 |
KSKAISKBOBRWHK-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522242; PubChem:CID135387066
|
Local ready
Direct docking supported
|
|
E3L022246
BDB022246
|
US11161839, Example 6b
Cn1c(=O)cc(NC(C)(C)c2ncccn2)c2cc(Nc3ccnc(Cl)c3Cl)ccc21
|
C22H20Cl2N6O 455.349000 |
MFDQAVHLEHLGJH-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522243; PubChem:CID142478273
|
Local ready
Direct docking supported
|
|
E3L022247
BDB022247
|
US11161839, Example 6c
CC(Nc1nc(=O)n(C)c2ccc(Nc3ccnc(Cl)c3Cl)cc12)c1ncccn1
|
C20H17Cl2N7O 442.310000 |
JAWNMJXBNIXTPM-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522244; PubChem:CID142478319
|
Local ready
Direct docking supported
|
|
E3L022248
BDB022248
|
US11161839, Example 6d
C[C@@H](Nc1nc(=O)n(C)c2ccc(Nc3ccnc(Cl)c3Cl)cc12)C1CC1
|
C19H19Cl2N5O 404.301000 |
OHGBTYZNURUNPW-SNVBAGLBSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522245; PubChem:CID142478244
|
Local ready
Direct docking supported
|
|
E3L022249
BDB022249
|
US11161839, Example 6e
CC(Nc1cc(=O)n(C)c2ncc(Nc3ccnc(Cl)c3Cl)cc12)c1ncccn1
|
C20H17Cl2N7O 442.310000 |
FQPBBWHXAZFJNS-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522246; PubChem:CID142478300
|
Local ready
Direct docking supported
|
|
E3L022250
BDB022250
|
US11161839, Example 6f
C[C@@H](Nc1cc(=O)n(C)c2ncc(Nc3ccnc(Cl)c3Cl)cc12)C1CC1
|
C19H19Cl2N5O 404.301000 |
NONRLRHWLCBHGM-SNVBAGLBSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522247; PubChem:CID142478421
|
Local ready
Direct docking supported
|
|
E3L022251
BDB022251
|
US11161839, Example 6g
CC(Nc1cc(=O)n(CC2CC2)c2ccc(Nc3ccnc(Cl)c3Cl)cc12)c1ncccn1
|
C24H22Cl2N6O 481.387000 |
XYVXLLDCTJEIIA-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522248; PubChem:CID135385944
|
Local ready
Direct docking supported
|
|
E3L022252
BDB022252
|
US11161839, Example 6h
C[C@@H]1CN(c2cc(Nc3ccc4c(c3)c(N[C@H](C)C3CC3)cc(=O)n4C)c(Cl)cn2)C[C@H](C)O1
|
C26H32ClN5O2 482.028000 |
ADDCKBODDSYYJB-IXDOHACOSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522249; PubChem:CID142478268
|
Local ready
Direct docking supported
|
|
E3L022253
BDB022253
|
US11161839, Example 6i
C[C@@H](Nc1cc(=O)n(C)c2ccc(Nc3cc(N4CCC(C(=O)N(C)C)CC4)ncc3Cl)cc12)C1CC1
|
C28H35ClN6O2 523.081000 |
CQZIZPKBOZPQHH-QGZVFWFLSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522250; PubChem:CID135385850
|
Local ready
Direct docking supported
|
|
E3L022254
BDB022254
|
US11161839, Example 6j
Cn1c(=O)cc(NC(C)(C)c2ncc(C3CC3)cn2)c2cc(Nc3ccnc(Cl)c3Cl)ccc21
|
C25H24Cl2N6O 495.414000 |
FOIVCZYPPHDBMK-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522251; PubChem:CID142478293
|
Local ready
Direct docking supported
|
|
E3L022255
BDB022255
|
US11161839, Example 7a
C[C@@H]1CN(c2cnc(C(C)(C)Nc3cc(=O)n(C)c4ccc(Nc5ccnc(Cl)c5C#N)cc34)nc2)C[C@H](C)O1
|
C29H31ClN8O2 559.074000 |
PBPDIUBXNIXBCN-HDICACEKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522252; PubChem:CID135385345
|
Local ready
Direct docking supported
|
|
E3L022256
BDB022256
|
US11161839, Example 7b
CNC(=O)c1cc(Nc2ccc3c(c2)C(NC(C)C2CC2)=CC(=O)C3N)c(C#N)c(Cl)n1
|
C23H23ClN6O2 450.930000 |
AJYPPTFFSSYKNA-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522253; PubChem:CID162679693
|
Local ready
Direct docking supported
|
|
E3L022257
BDB022257
|
US11161839, Example 7c
CNC(=O)c1cc(Nc2ccc3c(c2)c(NC(C)(C)C)cc(=O)n3C)c(C#N)c(Cl)n1
|
C22H23ClN6O2 438.919000 |
QRXKTUIBAHCLDV-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522254; PubChem:CID135385589
|
Local ready
Direct docking supported
|
|
E3L022258
BDB022258
|
US11161839, Example 7d
CNC(=O)c1cc(Nc2ccc3c(c2)c(NC(C)(C)COC)cc(=O)n3C)c(C#N)c(Cl)n1
|
C23H25ClN6O3 468.945000 |
FRXXZQQMRPDCOX-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522255; PubChem:CID142478441
|
Local ready
Direct docking supported
|
|
E3L022259
BDB022259
|
US11161839, Example 8a
Cn1c(=O)cc(NC(C)(C)c2ncccn2)c2cc(Nc3cc(C(=O)N4CCC4)nc(Cl)c3C#N)ccc21
|
C27H25ClN8O2 529.004000 |
MULJBGMEZYIOJT-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522256; PubChem:CID135385473
|
Local ready
Direct docking supported
|
|
E3L022260
BDB022260
|
US11161839, Example 8b
Cn1c(=O)cc(NC(C)(C)c2ncc(C3CC3)cn2)c2cc(Nc3cc(C(=O)N4CCC4)nc(Cl)c3C#N)ccc21
|
C30H29ClN8O2 569.069000 |
FPUAAXWDJCVQGZ-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM522257; PubChem:CID135386919
|
Local ready
Direct docking supported
|