| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L029141
BDB029141
|
BDBM582367
Cc1nc2c(c(-c3cc(C(N)=O)c(O)c(F)c3F)cn2CC(=O)Nc2cc(N3CCN(C(C)C)C[C@@H]3C)ncc2Cl)c(=O)n1C
|
C30H33ClF2N8O4 643.095000 |
AMCZKDNRHGTXOI-HNNXBMFYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582367
|
Local ready
Direct docking supported
|
|
E3L029142
BDB029142
|
BDBM582368
COc1ncc(Cl)c(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)c(F)c3F)c3c(=O)n(C)c(C)nc32)c1F
|
C23H18ClF3N6O5 550.881000 |
MRUIOSIXEQCMQJ-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582368; PubChem:CID155222790
|
Local ready
Direct docking supported
|
|
E3L029143
BDB029143
|
BDBM582369
COc1ncc(Cl)c(NC(=O)Cn2cc(-c3cc(Cl)c(O)c(C(N)=O)c3)c3c(=O)n(C)c(C)nc32)c1F
|
C23H19Cl2FN6O5 549.346000 |
REAARDRHJRDGFT-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582369; PubChem:CID155222757
|
Local ready
Direct docking supported
|
|
E3L029144
BDB029144
|
BDBM582370
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2ccc(F)cc2Cl)c1=O
|
C22H16Cl2FN5O4 504.305000 |
IUKHTNATQVGTRY-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582370; PubChem:CID155222649
|
Local ready
Direct docking supported
|
|
E3L029145
BDB029145
|
BDBM582371
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2ccc(C#N)cc2Cl)c1=O
|
C23H16Cl2N6O4 511.325000 |
ZELWALYRQCTOIX-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582371; PubChem:CID155222503
|
Local ready
Direct docking supported
|
|
E3L029146
BDB029146
|
BDBM582372
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1=O
|
C22H16Cl2N6O6 531.312000 |
NWWZNYFPLQARNB-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582372; PubChem:CID155222471
|
Local ready
Direct docking supported
|
|
E3L029147
BDB029147
|
BDBM582373
CO[C@@H]1CN(c2cc(NC(=O)Cn3cc(-c4cc(Cl)c(O)c(C(N)=O)c4)c4c(=O)n(C)c(C(F)(F)F)nc43)c(Cl)cn2)C[C@@H]1F
|
C27H23Cl2F4N7O5 672.423000 |
DCLWDZWHPVUPGZ-FUHWJXTLSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582373
|
Local ready
Direct docking supported
|
|
E3L029148
BDB029148
|
BDBM582374
CO[C@H]1CN(c2cc(NC(=O)Cn3cc(-c4cc(Cl)c(O)c(C(N)=O)c4)c4c(=O)n(C)c(C(F)(F)F)nc43)c(Cl)cn2)C[C@H]1F
|
C27H23Cl2F4N7O5 672.423000 |
DCLWDZWHPVUPGZ-AEFFLSMTSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582374
|
Local ready
Direct docking supported
|
|
E3L029149
BDB029149
|
BDBM582375
CO[C@@H]1CN(c2cc(NC(=O)Cn3cc(-c4cc(Cl)c(O)c(C(N)=O)c4)c4c(=O)n(C)c(C(F)(F)F)nc43)c(Cl)c(F)n2)C[C@@H]1F
|
C27H22Cl2F5N7O5 690.413000 |
BNIIKOWHELKBKH-GOEBONIOSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582375
|
Local ready
Direct docking supported
|
|
E3L029150
BDB029150
|
BDBM582376
CO[C@H]1CN(c2cc(NC(=O)Cn3cc(-c4cc(Cl)c(O)c(C(N)=O)c4)c4c(=O)n(C)c(C(F)(F)F)nc43)c(Cl)c(F)n2)C[C@H]1F
|
C27H22Cl2F5N7O5 690.413000 |
BNIIKOWHELKBKH-ZBFHGGJFSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582376
|
Local ready
Direct docking supported
|
|
E3L029151
BDB029151
|
BDBM582377
CCN1CCN(c2cc(NC(=O)Cn3cc(-c4cc(F)c(O)c(C(N)=O)c4)c4c(=O)n(C)cnc43)c(Cl)cn2)[C@@H](C)C1
|
C28H30ClFN8O4 597.051000 |
KRXMCCSHYWEMPB-HNNXBMFYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582377
|
Local ready
Direct docking supported
|
|
E3L029152
BDB029152
|
BDBM582378
CC(C1CC1)N1CCN(c2cc(NC(=O)Cn3cc(-c4cc(F)c(O)c(C(N)=O)c4)c4c(=O)n(C)cnc43)c(Cl)cn2)[C@@H](C)C1
|
C31H34ClFN8O4 637.116000 |
IYQFDAOPARQKNJ-BHWOMJMDSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582378
|
Local ready
Direct docking supported
|
|
E3L029153
BDB029153
|
BDBM582379
CC(C1CC1)N1CCN(c2cc(NC(=O)Cn3cc(-c4cc(Cl)c(O)c(C(N)=O)c4)c4c(=O)n(C)cnc43)c(Cl)cn2)[C@@H](C)C1
|
C31H34Cl2N8O4 653.571000 |
VXZAZHQUKQCIQX-BHWOMJMDSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582379
|
Local ready
Direct docking supported
|
|
E3L029154
BDB029154
|
BDBM582380
CC(C1CC1)N1CCN(c2cc(NC(=O)Cn3cc(-c4cc(C(N)=O)c(O)c(F)c4F)c4c(=O)n(C)cnc43)c(Cl)cn2)[C@@H](C)C1
|
C31H33ClF2N8O4 655.106000 |
QFXHVBOFQOXBQJ-VYRBHSGPSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582380
|
Local ready
Direct docking supported
|
|
E3L029155
BDB029155
|
BDBM582381
CCCN1CCN(c2cc(NC(=O)Cn3cc(-c4cc(C(N)=O)c(O)c(F)c4F)c4c(=O)n(C)cnc43)c(Cl)cn2)[C@@H](C)C1
|
C29H31ClF2N8O4 629.068000 |
ZMWRWVDOSFJNNW-HNNXBMFYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582381
|
Local ready
Direct docking supported
|
|
E3L029156
BDB029156
|
BDBM582382
CN1CCOC2CN(c3cc(NC(=O)Cn4cc(-c5cc(Cl)c(O)c(C(N)=O)c5)c5c(=O)n(C)c(C(F)(F)F)nc54)c(Cl)cn3)CC21
|
C29H27Cl2F3N8O5 695.486000 |
SSJCYFCGONNHMG-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582382
|
Local ready
Direct docking supported
|
|
E3L029157
BDB029157
|
BDBM582383
CN1CC2CCC(C1)N2c1cc(NC(=O)Cn2cc(-c3cc(Cl)c(O)c(C(N)=O)c3)c3c(=O)n(C)c(C(F)(F)F)nc32)c(Cl)cn1
|
C29H27Cl2F3N8O4 679.487000 |
FVJQECWLXPRWMM-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582383
|
Local ready
Direct docking supported
|
|
E3L029158
BDB029158
|
BDBM582384
C[C@H]1COCCN1c1cc(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)c(F)c3F)c3c(=O)n(C)cnc32)c(F)cn1
|
C26H24F3N7O5 571.516000 |
DFJLXFMVIMFOHX-LBPRGKRZSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582384; PubChem:CID155222643
|
Local ready
Direct docking supported
|
|
E3L029159
BDB029159
|
BDBM582385
COc1ccc(Cl)c(NC(=O)Cn2cc(-c3cc(Cl)c(O)c(C(N)=O)c3)c3c(=O)n(C)cnc32)c1
|
C23H19Cl2N5O5 516.341000 |
XZLHOXFSTPFDDC-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582385; PubChem:CID155222764
|
Local ready
Direct docking supported
|
|
E3L029160
BDB029160
|
BDBM582386
CO[C@@H]1CN(c2cc(NC(=O)Cn3cc(-c4cc(Cl)c(O)c(C(N)=O)c4)c4c(=O)n(C)c(C)nc43)c(Cl)c(F)n2)C[C@@H]1F
|
C27H25Cl2F2N7O5 636.443000 |
DLSUHCGBLHFQSS-FUHWJXTLSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582386
|
Local ready
Direct docking supported
|