| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L029021
BDB029021
|
BDBM582241
Cc1nc2c(c(-c3cc(F)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3CC(C)(C)N(C)C(C)(C)C3)ncc2Cl)c(=O)n1C
|
C31H36ClFN8O4 639.132000 |
JLIRBFMBTWIJIK-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582241
|
Local ready
Direct docking supported
|
|
E3L029022
BDB029022
|
BDBM582242
Cc1nc2c(c(-c3cc(C(N)=O)c(O)c(F)c3F)cn2CC(=O)Nc2cc(N3CCN(C)C[C@@H]3C)ncc2Cl)c(=O)n1C
|
C28H29ClF2N8O4 615.041000 |
JJACRWNCVAHDPS-ZDUSSCGKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582242
|
Local ready
Direct docking supported
|
|
E3L029023
BDB029023
|
BDBM582244
C[C@H]1CN(CC(F)(F)F)CCN1c1cc(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
|
C29H26Cl2F6N8O4 735.473000 |
VUMKGAKDEAUOIJ-ZDUSSCGKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582244
|
Local ready
Direct docking supported
|
|
E3L029024
BDB029024
|
BDBM582245
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)NC2CCCC[C@H]2OC(=O)C(F)(F)F)c1=O
|
C24H23ClF3N5O6 569.924000 |
PJELQKOEWLUNRC-OEMAIJDKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582245; PubChem:CID168511416
|
Local ready
Direct docking supported
|
|
E3L029025
BDB029025
|
BDBM582246
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)NC2CCCc3ccncc32)c1=O
|
C25H23ClN6O4 506.950000 |
GJOGQEYLVZVXNH-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582246; PubChem:CID155630748
|
Local ready
Direct docking supported
|
|
E3L029026
BDB029026
|
BDBM582247
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3CCOC(C(F)(F)F)C3)ncc2Cl)c1=O
|
C26H22Cl2F3N7O5 640.406000 |
BRUGFYDWUQTEGD-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582247; PubChem:CID139405716
|
Local ready
Direct docking supported
|
|
E3L029027
BDB029027
|
BDBM582248
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)NC2CCCc3ncccc32)c1=O
|
C25H23ClN6O4 506.950000 |
WEQRXOZEPDPNKN-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582248; PubChem:CID155630699
|
Local ready
Direct docking supported
|
|
E3L029028
BDB029028
|
BDBM582250
C[C@@H]1COC[C@@H](C)N1c1cc(NC(=O)Cn2cc(-c3cc(Cl)c(O)c(C(N)=O)c3)c3c(=O)n(C)cnc32)c(Cl)cn1
|
C27H27Cl2N7O5 600.463000 |
VRDBISSRWXVKIF-ZIAGYGMSSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582250; PubChem:CID155222732
|
Local ready
Direct docking supported
|
|
E3L029029
BDB029029
|
BDBM582251
C[C@H]1CN(C)CCN1c1cc(NC(=O)Cn2cc(-c3cc(Cl)c(O)c(C(N)=O)c3)c3c(=O)n(C)c(-c4ccccc4)nc32)c(Cl)cn1
|
C33H32Cl2N8O4 675.577000 |
FXAYPYUEWRLNHP-SFHVURJKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582251
|
Local ready
Direct docking supported
|
|
E3L029030
BDB029030
|
BDBM582252
C[C@H]1CN(C)CCN1c1cc(NC(=O)Cn2cc(-c3cc(Cl)c(O)c(C(N)=O)c3)c3c(=O)[nH]c(-c4ccccc4)nc32)c(Cl)cn1
|
C32H30Cl2N8O4 661.550000 |
APHFFOYJIPPHIT-KRWDZBQOSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582252
|
Local ready
Direct docking supported
|
|
E3L029031
BDB029031
|
BDBM582253
C[C@H]1COCCN1c1cc(NC(=O)Cn2cc(-c3cc(Cl)c(O)c(C(N)=O)c3)c3c(=O)n(C)c(Cl)nc32)c(Cl)cn1
|
C26H24Cl3N7O5 620.881000 |
KMLCKQSQKLMZFY-LBPRGKRZSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582253
|
Local ready
Direct docking supported
|
|
E3L029032
BDB029032
|
BDBM582254
C[C@H]1COCCN1c1cc(NC(=O)Cn2cc(-c3cc(Cl)c(O)c(C(N)=O)c3)c3c(=O)n(C)c(N(C)C)nc32)c(Cl)cn1
|
C28H30Cl2N8O5 629.505000 |
NAPLGETZISXKQT-AWEZNQCLSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582254
|
Local ready
Direct docking supported
|
|
E3L029033
BDB029033
|
BDBM582255
C[C@@H]1COC[C@H](C)N1c1cc(NC(=O)Cn2cc(-c3cc(Cl)c(O)c(C(N)=O)c3)c3c(=O)n(C)cnc32)c(Cl)cn1
|
C27H27Cl2N7O5 600.463000 |
VRDBISSRWXVKIF-OKILXGFUSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582255; PubChem:CID155222798
|
Local ready
Direct docking supported
|
|
E3L029034
BDB029034
|
BDBM582256
C[C@H]1CN(C)CCN1c1cc(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)c(F)c3F)c3c(=O)n(C)c(C(F)(F)F)nc32)c(Cl)cn1
|
C28H26ClF5N8O4 669.011000 |
OWZGDKKQAYXWKZ-LBPRGKRZSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582256
|
Local ready
Direct docking supported
|
|
E3L029035
BDB029035
|
BDBM582257
C[C@H]1CN(C)CCN1c1cc(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)c(CO)c3F)c3c(=O)n(C)c(C(F)(F)F)nc32)c(Cl)cn1
|
C29H29ClF4N8O5 681.047000 |
NWKHJNIHKLYXGI-ZDUSSCGKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582257
|
Local ready
Direct docking supported
|
|
E3L029036
BDB029036
|
BDBM582258
C[C@H]1CN(C)CCN1c1cc(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)c(Cl)c3F)c3c(=O)n(C)c(C(F)(F)F)nc32)c(Cl)cn1
|
C28H26Cl2F4N8O4 685.466000 |
PUSCRHZPHJQEED-LBPRGKRZSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582258
|
Local ready
Direct docking supported
|
|
E3L029037
BDB029037
|
BDBM582259
CNc1nc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3CCOC[C@@H]3C)ncc2Cl)c(=O)n1C
|
C27H28Cl2N8O5 615.478000 |
IQTUYNLTGPTKKQ-ZDUSSCGKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582259
|
Local ready
Direct docking supported
|
|
E3L029038
BDB029038
|
BDBM582260
CCN(C)c1nc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3CCOC[C@@H]3C)ncc2Cl)c(=O)n1C
|
C29H32Cl2N8O5 643.532000 |
UXFCYJFUTICLSQ-HNNXBMFYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582260
|
Local ready
Direct docking supported
|
|
E3L029039
BDB029039
|
BDBM582261
C[C@H]1COCCN1c1cc(NC(=O)Cn2cc(-c3cc(Cl)c(O)c(C(N)=O)c3)c3c(=O)n(C)c(N4CCC4)nc32)c(Cl)cn1
|
C29H30Cl2N8O5 641.516000 |
UIPDRDIVKRBOFJ-HNNXBMFYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582261
|
Local ready
Direct docking supported
|
|
E3L029040
BDB029040
|
BDBM582262
CC(C)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
|
C29H32Cl2N8O4 627.533000 |
NEVCDTBRHSDXBZ-INIZCTEOSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582262
|
Local ready
Direct docking supported
|