| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L028941
BDB028941
|
BDBM582157
C[C@@H]1CN(c2cc(NC(=O)Cn3cc(-c4cc(Cl)c(O)c(C(N)=O)c4)c4c(=O)[nH]cnc43)c(Cl)cn2)C[C@H](C)O1
|
C26H25Cl2N7O5 586.436000 |
CSOOVJVAJMEGAN-BETUJISGSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582157; PubChem:CID155222737
|
Local ready
Direct docking supported
|
|
E3L028942
BDB028942
|
BDBM582158
C[C@H]1COCCN1c1cc(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)c(Cl)c3F)c3c(=O)n(C)cnc32)c(Cl)cn1
|
C26H24Cl2FN7O5 604.426000 |
BFXKTMWQUPJEAL-LBPRGKRZSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582158
|
Local ready
Direct docking supported
|
|
E3L028943
BDB028943
|
BDBM582159
COc1c(O)c(C(N)=O)cc(-c2cn(CC(=O)Nc3cc(N4CCOC[C@@H]4C)ncc3Cl)c3ncn(C)c(=O)c23)c1F
|
C27H27ClFN7O6 600.007000 |
DKVQCGUDWKHUCR-ZDUSSCGKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582159
|
Local ready
Direct docking supported
|
|
E3L028944
BDB028944
|
BDBM582160
Cn1cnc2c(c(-c3cc(C(N)=O)c(O)c(Cl)c3F)cn2CC(=O)Nc2cc(N3CCOCC3)ncc2Cl)c1=O
|
C25H22Cl2FN7O5 590.399000 |
ZXZHSYFPIDZYMJ-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582160; PubChem:CID155222652
|
Local ready
Direct docking supported
|
|
E3L028945
BDB028945
|
BDBM582161
C[C@@H]1CN(c2cc(NC(=O)Cn3cc(-c4cc(C(N)=O)c(O)c(Cl)c4F)c4c(=O)n(C)cnc43)c(Cl)cn2)C[C@H](C)O1
|
C27H26Cl2FN7O5 618.453000 |
DECNENLQRQLIDC-BETUJISGSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582161
|
Local ready
Direct docking supported
|
|
E3L028946
BDB028946
|
BDBM582162
COc1c(O)c(C(N)=O)cc(-c2cn(CC(=O)Nc3cc(N4CCOCC4)ncc3Cl)c3ncn(C)c(=O)c23)c1F
|
C26H25ClFN7O6 585.980000 |
JRHDONJGRCDYJW-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582162; PubChem:CID155222493
|
Local ready
Direct docking supported
|
|
E3L028947
BDB028947
|
BDBM582163
COc1c(O)c(C(N)=O)cc(-c2cn(CC(=O)Nc3cc(N4C[C@@H](C)O[C@@H](C)C4)ncc3Cl)c3ncn(C)c(=O)c23)c1F
|
C28H29ClFN7O6 614.034000 |
XFKHAWDLKVUDHX-OKILXGFUSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582163
|
Local ready
Direct docking supported
|
|
E3L028948
BDB028948
|
BDBM582164
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cn3ccnc3cc2Cl)c1=O
|
C23H17Cl2N7O4 526.340000 |
KQKGHWFVPAFJBN-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582164; PubChem:CID155222571
|
Local ready
Direct docking supported
|
|
E3L028949
BDB028949
|
BDBM582165
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc3nccn3cc2Cl)c1=O
|
C23H17Cl2N7O4 526.340000 |
ODFQOEVFYBKFHN-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582165; PubChem:CID155222483
|
Local ready
Direct docking supported
|
|
E3L028950
BDB028950
|
BDBM582166
CN1CCN(c2ccc(Cl)c(NC(=O)Cn3cc(-c4cc(Cl)c(O)c(C(N)=O)c4)c4c(=O)n(C)cnc43)n2)CC1
|
C26H26Cl2N8O4 585.452000 |
HDTYMWJDWUNLJG-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582166; PubChem:CID155222642
|
Local ready
Direct docking supported
|
|
E3L028951
BDB028951
|
BDBM582167
Cn1cnc2c(c(-c3cc(F)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3CC4CCC(C3)O4)ncc2Cl)c1=O
|
C27H25ClFN7O5 581.992000 |
UADBJCYAFYQISW-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582167
|
Local ready
Direct docking supported
|
|
E3L028952
BDB028952
|
BDBM582168
CN1CCOC2(CCN(c3cc(NC(=O)Cn4cc(-c5cc(F)c(O)c(C(N)=O)c5)c5c(=O)n(C)cnc54)c(Cl)cn3)C2)C1
|
C29H30ClFN8O5 625.061000 |
WVHYFRPBLWLHOR-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582168
|
Local ready
Direct docking supported
|
|
E3L028953
BDB028953
|
BDBM582169
Cn1cnc2c(c(-c3cc(C(N)=O)c(O)c(F)c3F)cn2CC(=O)Nc2cc(N3CCOCC3)ncc2Cl)c1=O
|
C25H22ClF2N7O5 573.944000 |
MTUDDRYUPDDUQE-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582169; PubChem:CID155222659
|
Local ready
Direct docking supported
|
|
E3L028954
BDB028954
|
BDBM582170
C[C@@H]1CN(c2cc(NC(=O)Cn3cc(-c4cc(C(N)=O)c(O)c(F)c4F)c4c(=O)n(C)cnc43)c(Cl)cn2)C[C@H](C)O1
|
C27H26ClF2N7O5 601.998000 |
MIZDZWJIGUJJAH-BETUJISGSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582170
|
Local ready
Direct docking supported
|
|
E3L028955
BDB028955
|
BDBM582171
C[C@H]1COCCN1c1cc(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)c(F)c3F)c3c(=O)n(C)cnc32)c(Cl)cn1
|
C26H24ClF2N7O5 587.971000 |
CSUHEPAXDDMODK-LBPRGKRZSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582171; PubChem:CID155222750
|
Local ready
Direct docking supported
|
|
E3L028956
BDB028956
|
BDBM582172
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc3cnn(C)c3cc2Cl)c1=O
|
C24H19Cl2N7O4 540.367000 |
PDQGTTJOVMANCM-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582172; PubChem:CID155222417
|
Local ready
Direct docking supported
|
|
E3L028957
BDB028957
|
BDBM582173
Cn1cc2cc(NC(=O)Cn3cc(-c4cc(Cl)c(O)c(C(N)=O)c4)c4c(=O)n(C)cnc43)c(Cl)cc2n1
|
C24H19Cl2N7O4 540.367000 |
OEQVADLEYQODJY-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582173; PubChem:CID155222545
|
Local ready
Direct docking supported
|
|
E3L028958
BDB028958
|
BDBM582174
CN1CCc2cc(NC(=O)Cn3cc(-c4cc(Cl)c(O)c(C(N)=O)c4)c4c(=O)n(C)cnc43)c(Cl)cc21
|
C25H22Cl2N6O4 541.395000 |
JDKUTNKUXLWBSW-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582174; PubChem:CID155222462
|
Local ready
Direct docking supported
|
|
E3L028959
BDB028959
|
BDBM582175
CN1CCOC2(CCN(c3cc(NC(=O)Cn4cc(-c5cc(C(N)=O)c(O)cc5F)c5c(=O)n(C)cnc54)c(Cl)cn3)C2)C1
|
C29H30ClFN8O5 625.061000 |
VESJDVBKXPXTAL-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582175
|
Local ready
Direct docking supported
|
|
E3L028960
BDB028960
|
BDBM582176
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2c(Cl)cnc(N3CCOCC3)c2F)c1=O
|
C25H22Cl2FN7O5 590.399000 |
JFALQKIHLZCXMH-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582176; PubChem:CID155222593
|
Local ready
Direct docking supported
|