| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L029041
BDB029041
|
BDBM582263
Cc1nc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3CCN(C(C)C)C[C@@H]3C)ncc2Cl)c(=O)n1C
|
C30H34Cl2N8O4 641.560000 |
ULXUHUBSKFKDFQ-INIZCTEOSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582263
|
Local ready
Direct docking supported
|
|
E3L029042
BDB029042
|
BDBM582264
Cn1cnc2c(c(-c3cc(F)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3CCCC3)ncc2Cl)c1=O
|
C25H23ClFN7O4 539.955000 |
UIIPCUFVWAEOOG-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582264; PubChem:CID155222523
|
Local ready
Direct docking supported
|
|
E3L029043
BDB029043
|
BDBM582265
CC(C)N1CCN(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@@H](C)C1
|
C30H31Cl2F3N8O4 695.530000 |
ZRNWIGCXGMKWRL-HNNXBMFYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582265
|
Local ready
Direct docking supported
|
|
E3L029044
BDB029044
|
BDBM582266
Cn1cnc2c(c(-c3cc(F)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3CC4COCC4C3)ncc2Cl)c1=O
|
C27H25ClFN7O5 581.992000 |
OXJWBSQMZKAGNB-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582266
|
Local ready
Direct docking supported
|
|
E3L029045
BDB029045
|
BDBM582267
CN1CCC2CN(c3cc(NC(=O)Cn4cc(-c5cc(F)c(O)c(C(N)=O)c5)c5c(=O)n(C)cnc54)c(Cl)cn3)CC21
|
C28H28ClFN8O4 595.035000 |
NAHQHAWPHRYOMK-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582267
|
Local ready
Direct docking supported
|
|
E3L029046
BDB029046
|
BDBM582268
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3CCOC4COCC43)ncc2Cl)c1=O
|
C27H25Cl2N7O6 614.446000 |
XRHSGOYHOOORID-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582268
|
Local ready
Direct docking supported
|
|
E3L029047
BDB029047
|
BDBM582269
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3CC4CCC(F)(F)C4C3)ncc2Cl)c1=O
|
C28H25Cl2F2N7O4 632.455000 |
IKLJZSRRNZZCIG-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582269
|
Local ready
Direct docking supported
|
|
E3L029048
BDB029048
|
BDBM582270
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3C4CCC3COC4)ncc2Cl)c1=O
|
C27H25Cl2N7O5 598.447000 |
GBYLVCPVLPYSHP-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582270
|
Local ready
Direct docking supported
|
|
E3L029049
BDB029049
|
BDBM582271
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3CCOC4CCCC43)ncc2Cl)c1=O
|
C28H27Cl2N7O5 612.474000 |
SIIJQHPPEMTNPE-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582271
|
Local ready
Direct docking supported
|
|
E3L029050
BDB029050
|
BDBM582272
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3C4COCC5CC543)ncc2Cl)c1=O
|
C27H23Cl2N7O5 596.431000 |
PAEOHFGEQOQFQQ-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582272
|
Local ready
Direct docking supported
|
|
E3L029051
BDB029051
|
BDBM582273
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3CC4CC(C3)O4)ncc2Cl)c1=O
|
C26H23Cl2N7O5 584.420000 |
HIYAWSPJCWGUJG-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582273
|
Local ready
Direct docking supported
|
|
E3L029052
BDB029052
|
BDBM582274
CN1C2CCC1CN(c1cc(NC(=O)Cn3cc(-c4cc(F)c(O)c(C(N)=O)c4)c4c(=O)n(C)cnc43)c(Cl)cn1)C2
|
C28H28ClFN8O4 595.035000 |
KVNCAWQRLFMULZ-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582274
|
Local ready
Direct docking supported
|
|
E3L029053
BDB029053
|
BDBM582275
Cn1cnc2c(c(-c3cc(F)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3CC4CC3CO4)ncc2Cl)c1=O
|
C26H23ClFN7O5 567.965000 |
DNLHLZBGIKFRQV-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582275
|
Local ready
Direct docking supported
|
|
E3L029054
BDB029054
|
BDBM582276
CN1C2CCC1CN(c1cc(NC(=O)Cn3cc(-c4cc(C(N)=O)c(O)c(F)c4F)c4c(=O)n(C)cnc43)c(Cl)cn1)C2
|
C28H27ClF2N8O4 613.025000 |
MUSOEBJRBFNHIM-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582276
|
Local ready
Direct docking supported
|
|
E3L029055
BDB029055
|
BDBM582277
Cn1cnc2c(c(-c3cc(C(N)=O)c(O)c(F)c3F)cn2CC(=O)Nc2cc(N3CC4CC3CO4)ncc2Cl)c1=O
|
C26H22ClF2N7O5 585.955000 |
KAMFGLPKMHBUKQ-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582277
|
Local ready
Direct docking supported
|
|
E3L029056
BDB029056
|
BDBM582278
CN1CC2CN(c3cc(NC(=O)Cn4cc(-c5cc(F)c(O)c(C(N)=O)c5)c5c(=O)n(C)cnc54)c(Cl)cn3)CC2C1
|
C28H28ClFN8O4 595.035000 |
ATBVXGWYVPWCHW-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582278
|
Local ready
Direct docking supported
|
|
E3L029057
BDB029057
|
BDBM582279
CN(C)c1cc(NC(=O)Cn2cc(-c3cc(F)c(O)c(C(N)=O)c3)c3c(=O)n(C)cnc32)c(Cl)cn1
|
C23H21ClFN7O4 513.917000 |
VYSWQVKGCVJATR-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582279; PubChem:CID155222457
|
Local ready
Direct docking supported
|
|
E3L029058
BDB029058
|
BDBM582280
CN1CCCN(c2cc(NC(=O)Cn3cc(-c4cc(F)c(O)c(C(N)=O)c4)c4c(=O)n(C)cnc43)c(Cl)cn2)CC1
|
C27H28ClFN8O4 583.024000 |
DQNTUAJUQWBDKZ-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582280; PubChem:CID155222553
|
Local ready
Direct docking supported
|
|
E3L029059
BDB029059
|
BDBM582281
COc1cc(NC(=O)Cn2cc(-c3cc(Cl)c(O)c(C(N)=O)c3)c3c(=O)n(C)c(O)nc32)c(Cl)cn1
|
C22H18Cl2N6O6 533.328000 |
CZCPHJPXORQMMD-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582281; PubChem:CID155222675
|
Local ready
Direct docking supported
|
|
E3L029060
BDB029060
|
BDBM582282
CN(C)c1cc(NC(=O)Cn2cc(-c3cc(Cl)c(O)c(C(N)=O)c3)c3c(=O)n(C)c(Nc4cc(N(C)C)ncc4Cl)nc32)c(Cl)cn1
|
C30H29Cl3N10O4 699.987000 |
DKOFRMLHZCRSED-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582282
|
Local ready
Direct docking supported
|