| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L028981
BDB028981
|
BDBM582200
C=Cc1cc(NC(=O)Cn2cc(-c3cc(Cl)c(O)c(C(N)=O)c3)c3c(=O)n(C)cnc32)c(Cl)cn1
|
C23H18Cl2N6O4 513.341000 |
REPNLOMYGONEPY-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582200; PubChem:CID139405599
|
Local ready
Direct docking supported
|
|
E3L028982
BDB028982
|
BDBM582201
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2c(F)c(F)nc(F)c2Cl)c1=O
|
C21H13Cl2F3N6O4 541.273000 |
NQEIXGCEHXKPAZ-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582201; PubChem:CID139405728
|
Local ready
Direct docking supported
|
|
E3L028983
BDB028983
|
BDBM582202
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)NC2CCCCC2)c1=O
|
C22H24ClN5O4 457.918000 |
SOOJUTVBIJPZAB-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582202; PubChem:CID139405733
|
Local ready
Direct docking supported
|
|
E3L028984
BDB028984
|
BDBM582203
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3CCOCC3(C)C)ncc2Cl)c1=O
|
C27H27Cl2N7O5 600.463000 |
HIZSMCIPYIPGCK-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582203; PubChem:CID139405729
|
Local ready
Direct docking supported
|
|
E3L028985
BDB028985
|
BDBM582204
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc3c(cc2Cl)OCCN3CCN2CCOCC2)c1=O
|
C30H31Cl2N7O6 656.527000 |
NHKKLEUTOCLERR-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582204
|
Local ready
Direct docking supported
|
|
E3L028986
BDB028986
|
BDBM582205
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc3c(cc2Cl)OCC(=O)N3CCN2CCOCC2)c1=O
|
C30H29Cl2N7O7 670.510000 |
RQSQEJQDEDORNT-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582205
|
Local ready
Direct docking supported
|
|
E3L028987
BDB028987
|
BDBM582206
CN(C)CC1CN(c2cc(NC(=O)Cn3cc(-c4cc(Cl)c(O)c(C(N)=O)c4)c4c(=O)n(C)cnc43)c(Cl)cn2)CCO1
|
C28H30Cl2N8O5 629.505000 |
CDMKMJOTSCJROP-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582206
|
Local ready
Direct docking supported
|
|
E3L028988
BDB028988
|
BDBM582207
C[C@H]1COCCN1c1cc(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
|
C27H24Cl2F3N7O5 654.433000 |
GXLLQQSBENYGLM-LBPRGKRZSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582207
|
Local ready
Direct docking supported
|
|
E3L028989
BDB028989
|
BDBM582208
Cn1cnc2c(c(-c3cc(F)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3CCOCC3)ncc2F)c1=O
|
C25H23F2N7O5 539.499000 |
WPNVCBAYBMWEIJ-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582208; PubChem:CID155222635
|
Local ready
Direct docking supported
|
|
E3L028990
BDB028990
|
BDBM582209
C[C@@H]1CN(c2cc(NC(=O)Cn3cc(-c4cc(F)c(O)c(C(N)=O)c4)c4c(=O)n(C)cnc43)c(Cl)cn2)C[C@H](C)N1
|
C27H28ClFN8O4 583.024000 |
BOHASYOJSUDZIU-OKILXGFUSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582209; PubChem:CID155222528
|
Local ready
Direct docking supported
|
|
E3L028991
BDB028991
|
BDBM582210
Cn1cnc2c(c(-c3cc(F)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3CCOCC3)c(F)cc2Cl)c1=O
|
C26H23ClF2N6O5 572.956000 |
PXLULBZKUPYZEV-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582210; PubChem:CID155222491
|
Local ready
Direct docking supported
|
|
E3L028992
BDB028992
|
BDBM582211
C[C@H]1CN(C)CCN1c1cc(NC(=O)Cn2cc(-c3cc(F)c(O)c(C(N)=O)c3)c3c(=O)n(C)cnc32)c(Cl)cn1
|
C27H28ClFN8O4 583.024000 |
MPTZCPVBMHMFLN-AWEZNQCLSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582211; PubChem:CID155222415
|
Local ready
Direct docking supported
|
|
E3L028993
BDB028993
|
BDBM582212
CN1C(C)(C)CN(c2cc(NC(=O)Cn3cc(-c4cc(F)c(O)c(C(N)=O)c4)c4c(=O)n(C)cnc43)c(Cl)cn2)CC1(C)C
|
C30H34ClFN8O4 625.105000 |
PHMZGZYVXXXZGC-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582212
|
Local ready
Direct docking supported
|
|
E3L028994
BDB028994
|
BDBM582213
Cn1cnc2c(c(-c3cc(C(N)=O)c(O)cc3F)cn2CC(=O)Nc2cc(N3CCOCC3)ncc2F)c1=O
|
C25H23F2N7O5 539.499000 |
CBEYDEBNDJUYAW-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582213; PubChem:CID155222753
|
Local ready
Direct docking supported
|
|
E3L028995
BDB028995
|
BDBM582214
C[C@H]1CN(C)CCN1c1cc(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)cc3F)c3c(=O)n(C)cnc32)c(Cl)cn1
|
C27H28ClFN8O4 583.024000 |
JBGHAGWRFHZKDB-AWEZNQCLSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582214; PubChem:CID155222425
|
Local ready
Direct docking supported
|
|
E3L028996
BDB028996
|
BDBM582215
Cn1cnc2c(c(-c3cc(C(N)=O)c(O)c(F)c3F)cn2CC(=O)Nc2cc(N3CC4CCOC4C3)ncc2Cl)c1=O
|
C27H24ClF2N7O5 599.982000 |
FOONDNZWYKJTSB-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582215
|
Local ready
Direct docking supported
|
|
E3L028997
BDB028997
|
BDBM582216
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)N1
|
C27H27ClF2N8O4 601.014000 |
LJTBTVJEDWEECA-BETUJISGSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582216
|
Local ready
Direct docking supported
|
|
E3L028998
BDB028998
|
BDBM582217
Cc1nc2cc(Cl)c(NC(=O)Cn3cc(-c4cc(C(N)=O)c(O)c(F)c4F)c4c(=O)n(C)cnc43)cc2o1
|
C24H17ClF2N6O5 542.886000 |
UOIOWBSIPBGMDE-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582217; PubChem:CID155222666
|
Local ready
Direct docking supported
|
|
E3L028999
BDB028999
|
BDBM582218
Cn1cnc2c(c(-c3cc(C(N)=O)c(O)c(F)c3F)cn2CC(=O)Nc2cc(N3CCOCC3)c(F)cc2Cl)c1=O
|
C26H22ClF3N6O5 590.946000 |
PQMRDNDZSSOZOB-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582218; PubChem:CID155222619
|
Local ready
Direct docking supported
|
|
E3L029000
BDB029000
|
BDBM582219
C[C@H]1CN(C)CCN1c1cc(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)c(F)c3F)c3c(=O)n(C)cnc32)c(Cl)cn1
|
C27H27ClF2N8O4 601.014000 |
UWECVQGTVIRVDC-ZDUSSCGKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582219
|
Local ready
Direct docking supported
|