| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L029081
BDB029081
|
BDBM582306
Cc1nc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3CCOC[C@@H]3C)nc(F)c2Cl)c(=O)n1C
|
C27H26Cl2FN7O5 618.453000 |
GSBRFYGEIOZTBH-LBPRGKRZSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582306
|
Local ready
Direct docking supported
|
|
E3L029082
BDB029082
|
BDBM582307
Cc1nc2c(c(-c3cc(C(N)=O)c(O)c(F)c3F)cn2CC(=O)Nc2cc(N3CCOC[C@@H]3C)nc(F)c2Cl)c(=O)n1C
|
C27H25ClF3N7O5 619.988000 |
QZJMWVZPPBHKNS-NSHDSACASA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582307
|
Local ready
Direct docking supported
|
|
E3L029083
BDB029083
|
BDBM582308
C[C@H]1COCCN1c1cc(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)c(F)c3F)c3c(=O)n(C)cnc32)c(Cl)c(F)n1
|
C26H23ClF3N7O5 605.961000 |
XPYMYLDVWFMANC-NSHDSACASA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582308
|
Local ready
Direct docking supported
|
|
E3L029084
BDB029084
|
BDBM582309
Cn1cnc2c(c(-c3cc(C(N)=O)c(O)c(F)c3F)cn2CC(=O)Nc2cc(N3CCOCC3)nc(F)c2Cl)c1=O
|
C25H21ClF3N7O5 591.934000 |
ULCZKMMWMAYEFC-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582309; PubChem:CID155222765
|
Local ready
Direct docking supported
|
|
E3L029085
BDB029085
|
BDBM582310
C[C@H]1COCCN1c1cc(NC(=O)Cn2cc(-c3cc(F)c(O)c(C(N)=O)c3)c3c(=O)n(C)cnc32)c(Cl)c(F)n1
|
C26H24ClF2N7O5 587.971000 |
PECNRMJCICZGDC-LBPRGKRZSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582310
|
Local ready
Direct docking supported
|
|
E3L029086
BDB029086
|
BDBM582311
CN1CC2CCC(C1)N2c1cc(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)c(F)c3F)c3c(=O)n(C)cnc32)c(Cl)cn1
|
C28H27ClF2N8O4 613.025000 |
ZPGCGAMBDKRWMY-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582311
|
Local ready
Direct docking supported
|
|
E3L029087
BDB029087
|
BDBM582312
C[C@H]1COCCN1c1cc(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)c(F)c3F)c3c(=O)n(CC#Cc4cnn(C)c4)cnc32)c(Cl)cn1
|
C32H28ClF2N9O5 692.083000 |
VLZJNMAWYLZRQP-KRWDZBQOSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582312
|
Local ready
Direct docking supported
|
|
E3L029088
BDB029088
|
BDBM582313
C=C(C)c1nc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3CCN(C)C[C@@H]3C)ncc2Cl)c(=O)n1C
|
C30H32Cl2N8O4 639.544000 |
OKLGKKXEHPBPEK-INIZCTEOSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582313
|
Local ready
Direct docking supported
|
|
E3L029089
BDB029089
|
BDBM582314
COCn1c(Cl)nc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2cc(N3CCN(C)C[C@@H]3C)ncc2Cl)c1=O
|
C28H29Cl3N8O5 663.950000 |
ZTYYDPWQOLOYFW-AWEZNQCLSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582314
|
Local ready
Direct docking supported
|
|
E3L029090
BDB029090
|
BDBM582315
CN1CC2CC1CN2c1cc(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)c(F)c3F)c3c(=O)n(C)cnc32)c(Cl)cn1
|
C27H25ClF2N8O4 598.998000 |
RRCFFFNGTQINRQ-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582315
|
Local ready
Direct docking supported
|
|
E3L029091
BDB029091
|
BDBM582316
CN1CCOC2CN(c3cc(NC(=O)Cn4cc(-c5cc(C(N)=O)c(O)c(F)c5F)c5c(=O)n(C)cnc54)c(Cl)cn3)CC21
|
C28H27ClF2N8O5 629.024000 |
DZSJOASHJHGVDP-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582316
|
Local ready
Direct docking supported
|
|
E3L029092
BDB029092
|
BDBM582317
CN(C)C1CN(c2cc(NC(=O)Cn3cc(-c4cc(C(N)=O)c(O)c(F)c4F)c4c(=O)n(C)cnc43)c(Cl)cn2)C1
|
C26H25ClF2N8O4 586.987000 |
RXPIVMFRBSCAHC-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582317; PubChem:CID155222577
|
Local ready
Direct docking supported
|
|
E3L029093
BDB029093
|
BDBM582318
CN1CCN(c2cc(NC(=O)Cn3cc(-c4cc(C(N)=O)c(O)c(F)c4F)c4c(=O)n(C)cnc43)c(Cl)cn2)C(C)(C)C1
|
C28H29ClF2N8O4 615.041000 |
ARDYQZCAFHGDIM-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582318; PubChem:CID155222748
|
Local ready
Direct docking supported
|
|
E3L029094
BDB029094
|
BDBM582319
Cn1cnc2c(c(-c3cc(Cl)c(O)c(C(N)=O)c3)cn2CC(=O)Nc2nc(N3CCOCC3)c(F)cc2Cl)c1=O
|
C25H22Cl2FN7O5 590.399000 |
HBZXSSWNTOQFMQ-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582319; PubChem:CID155222689
|
Local ready
Direct docking supported
|
|
E3L029095
BDB029095
|
BDBM582320
CN1CCOC2CN(c3cc(NC(=O)Cn4cc(-c5cc(Cl)c(O)c(C(N)=O)c5)c5c(=O)n(C)cnc54)c(Cl)cn3)CC21
|
C28H28Cl2N8O5 627.489000 |
DLEZVLMDWHISFE-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582320
|
Local ready
Direct docking supported
|
|
E3L029096
BDB029096
|
BDBM582321
CN(C)CC1COCCN1c1cc(NC(=O)Cn2cc(-c3cc(Cl)c(O)c(C(N)=O)c3)c3c(=O)n(C)cnc32)c(Cl)cn1
|
C28H30Cl2N8O5 629.505000 |
UNOASBJOXPXTGG-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582321
|
Local ready
Direct docking supported
|
|
E3L029097
BDB029097
|
BDBM582322
CCN1CCN(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
|
C28H30Cl2N8O4 613.506000 |
UPMKVCJVTANNAP-HNNXBMFYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582322
|
Local ready
Direct docking supported
|
|
E3L029098
BDB029098
|
BDBM582323
CCN1CCN(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
|
C28H29ClF2N8O4 615.041000 |
XFPNAULTTRZFPF-AWEZNQCLSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB
BindingDB:BDBM582323
|
Local ready
Direct docking supported
|
|
E3L029099
BDB029099
|
BDBM582324
Cc1cc(NC(=O)Cn2cc(-c3cc(C(N)=O)c(O)c(F)c3F)c3c(=O)n(C)cnc32)c(Cl)cn1
|
C22H17ClF2N6O4 502.865000 |
BBZSAIDFDXDVMM-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582324; PubChem:CID155222756
|
Local ready
Direct docking supported
|
|
E3L029100
BDB029100
|
BDBM582325
Cc1cc(NC(=O)Cn2cc(-c3cc(Cl)c(O)c(C(N)=O)c3)c3c(=O)n(C)cnc32)c(Cl)cn1
|
C22H18Cl2N6O4 501.330000 |
PGGAEURTUVTHNL-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM582325; PubChem:CID155222432
|
Local ready
Direct docking supported
|