| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L029221
BDB029221
|
BDBM582447
C[C@H]1CN(CC2CCO2)CCN1c1cc(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)c(F)c3F)c3c(=O)n(C)cnc32)c(Cl)c(F)n1
|
C30H30ClF3N8O5 675.068000 |
GXGJDWKRWJJAFK-MLCCFXAWSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582447
|
Local ready
Direct docking supported
|
|
E3L029222
BDB029222
|
BDBM582448
COc1nc2c(c(-c3cc(C(N)=O)c(O)c(F)c3F)cn2CC(=O)Nc2cc(N3CCN(C)C[C@@H]3C)nc(F)c2Cl)c(=O)n1C
|
C28H28ClF3N8O5 649.030000 |
YAULVJSIQRRWRW-LBPRGKRZSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582448
|
Local ready
Direct docking supported
|
|
E3L029223
BDB029223
|
BDBM582449
CO[C@@H](C)CN1CCN(c2cc(NC(=O)Cn3cc(-c4cc(C(N)=O)c(O)c(F)c4F)c4c(=O)n(C)cnc43)c(Cl)c(F)n2)[C@@H](C)C1
|
C30H32ClF3N8O5 677.084000 |
LLVUOTJSSVVBBH-GJZGRUSLSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582449
|
Local ready
Direct docking supported
|
|
E3L029224
BDB029224
|
BDBM582450
C[C@H]1CN(CC(CO)CO)CCN1c1cc(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)c(F)c3F)c3c(=O)n(C)cnc32)c(Cl)c(F)n1
|
C30H32ClF3N8O6 693.083000 |
ONNJMABXVGDKHY-AWEZNQCLSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582450
|
Local ready
Direct docking supported
|
|
E3L029225
BDB029225
|
BDBM582451
C[C@H]1CN(CCC(F)(F)F)CCN1c1cc(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)c(F)c3F)c3c(=O)n(C)cnc32)c(Cl)c(F)n1
|
C29H27ClF6N8O4 701.028000 |
BIPUGOGJMYPDRS-ZDUSSCGKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582451
|
Local ready
Direct docking supported
|
|
E3L029226
BDB029226
|
BDBM582452
Cn1cnc2c(c(-c3cc(C(N)=O)c(O)c(F)c3F)cn2CC(=O)Nc2cc(N3C4CCC3CN(CC(F)(F)F)C4)ncc2Cl)c1=O
|
C29H26ClF5N8O4 681.022000 |
QOYPJPHUCHRNJJ-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582452
|
Local ready
Direct docking supported
|
|
E3L029227
BDB029227
|
BDBM582453
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3C4CCC3CN(CC(F)(F)F)C4)ncc2Cl)c1=O
|
C29H27Cl2F3N8O4 679.487000 |
SOZVYTOAZSYZRF-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582453
|
Local ready
Direct docking supported
|
|
E3L029228
BDB029228
|
BDBM582454
Cn1cnc2c(c(-c3cc(F)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3C4CCC3CN(CC(F)(F)F)C4)ncc2Cl)c1=O
|
C29H27ClF4N8O4 663.032000 |
MOVOXQAWOZDUIE-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582454
|
Local ready
Direct docking supported
|
|
E3L029229
BDB029229
|
BDBM582455
Cn1cnc2c(c(-c3cc(C(N)=O)c(O)c(F)c3F)cn2CC(=O)Nc2cc(N3Cc4ccncc4C3)ncc2Cl)c1=O
|
C28H21ClF2N8O4 606.977000 |
OJDOQQGABPYXBO-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582455
|
Local ready
Direct docking supported
|
|
E3L029230
BDB029230
|
BDBM582456
C[C@H]1CN(CC(F)F)CCN1c1cc(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)c(F)c3F)c3c(=O)n(C)cnc32)c(Cl)c(F)n1
|
C28H26ClF5N8O4 669.011000 |
SLRYVOCRENYHKE-LBPRGKRZSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582456
|
Local ready
Direct docking supported
|
|
E3L029231
BDB029231
|
BDBM582457
C[C@H]1CN(C)C[C@H](C)N1c1cc(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)c(F)c3F)c3c(=O)n(C)cnc32)c(Cl)cn1
|
C28H29ClF2N8O4 615.041000 |
JPPAZZGREKQIKI-KBPBESRZSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582457
|
Local ready
Direct docking supported
|
|
E3L029232
BDB029232
|
BDBM582458
C[C@H]1CN(C)CCN1c1cc(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)c4c3OCO4)c3c(=O)n(C)cnc32)c(Cl)c(F)n1
|
C28H28ClFN8O6 627.033000 |
UMJJCRBHNLSKPZ-ZDUSSCGKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582458
|
Local ready
Direct docking supported
|
|
E3L029233
BDB029233
|
BDBM582459
C[C@H]1COCCN1c1cc(NC(=O)Cn2cc(-c3cc(F)c(O)c(C(N)=O)c3F)c3c(=O)n(C)cnc32)c(Cl)c(F)n1
|
C26H23ClF3N7O5 605.961000 |
VBVGDAADDSVOSJ-NSHDSACASA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582459
|
Local ready
Direct docking supported
|
|
E3L029234
BDB029234
|
BDBM582460
C[C@H]1CN(C)CCN1c1cc(NC(=O)Cn2cc(-c3cc(F)c(O)c(C(N)=O)c3F)c3c(=O)n(C)cnc32)c(Cl)c(F)n1
|
C27H26ClF3N8O4 619.004000 |
YTJOTKRDVPGQRE-LBPRGKRZSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582460
|
Local ready
Direct docking supported
|
|
E3L029235
BDB029235
|
BDBM582461
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3C[C@H]4CC[C@@H](C3)N4CC(F)(F)F)ncc2Cl)c1=O
|
C29H27Cl2F3N8O4 679.487000 |
LIRDQYAKVPNIFT-IYBDPMFKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582461
|
Local ready
Direct docking supported
|
|
E3L029236
BDB029236
|
BDBM582462
Cn1cnc2c(c(-c3cc(C(N)=O)c(O)c(F)c3F)cn2CC(=O)Nc2cc(N3C[C@H]4CC[C@@H](C3)N4CC(F)(F)F)ncc2Cl)c1=O
|
C29H26ClF5N8O4 681.022000 |
DURVTCKJXCTVAC-OKILXGFUSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582462
|
Local ready
Direct docking supported
|
|
E3L029237
BDB029237
|
BDBM582463
Cn1cnc2c(c(-c3cc(F)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3C[C@H]4CC[C@@H](C3)N4CC(F)(F)F)ncc2Cl)c1=O
|
C29H27ClF4N8O4 663.032000 |
UBQFEMCIEVWZDT-IYBDPMFKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582463
|
Local ready
Direct docking supported
|
|
E3L029238
BDB029238
|
BDBM582464
CN1CC2CCC(C1)N2c1cc(NC(=O)Cn2cc(-c3cc(F)c(O)c(C(N)=O)c3)c3c(=O)n(C)cnc32)c(Cl)cn1
|
C28H28ClFN8O4 595.035000 |
HKPHFTQJIZETCZ-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582464
|
Local ready
Direct docking supported
|
|
E3L029239
BDB029239
|
BDBM582465
CN1CCN(c2cc(NC(=O)Cn3cc(-c4cc(F)c(O)c(C(N)=O)c4)c4c(=O)n(CC#Cc5cnn(C)c5)cnc43)c(Cl)cn2)CC1
|
C32H30ClFN10O4 673.109000 |
CKJQCEPCBCVCFG-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582465
|
Local ready
Direct docking supported
|
|
E3L029240
BDB029240
|
BDBM582466
CN1CCC2(C1)CN(c1cc(NC(=O)Cn3cc(-c4cc(Cl)c(O)c(C(N)=O)c4)c4c(=O)n(C)cnc43)c(Cl)cn1)C2
|
C28H28Cl2N8O4 611.490000 |
KRKBMKZJUVKLBG-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582466
|
Local ready
Direct docking supported
|