| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L031181
BDB031181
|
US20230312542, Example 111
COc1cc(C(C(=O)N2C[C@H](O)C[C@H]2c2nc(C(=O)N3CCC(c4ccccc4)C3)c[nH]2)C(C)C)on1
|
C27H33N5O5 507.591000 |
WJNAJYHCXUNFEN-YQVSFNRTSA-N | P40337 | von Hippel-Lindau disease tumor suppressor |
BindingDB, PubChem
BindingDB:BDBM622023; PubChem:CID156873346
|
Local ready
Direct docking supported
|
|
E3L031182
BDB031182
|
US20230312542, Example 112
COc1cc(C(C(=O)N2C[C@H](O)C[C@H]2c2ncc[nH]2)C(C)C)on1
|
C16H22N4O4 334.376000 |
RXXYAIKNNGKDOV-ZAZPPBBNSA-N | P40337 | von Hippel-Lindau disease tumor suppressor |
BindingDB, PubChem
BindingDB:BDBM622024; PubChem:CID156873317
|
Local ready
Direct docking supported
|
|
E3L031183
BDB031183
|
US20230312542, Example 113
COc1cc(C(C(=O)N2C[C@H](O)C[C@H]2c2nccn2Cc2cncc(-c3ccc(F)cc3)c2)C(C)C)on1
|
C28H30FN5O4 519.577000 |
NMGBNTDVUCXBSE-DBRKUKIDSA-N | P40337 | von Hippel-Lindau disease tumor suppressor |
BindingDB, PubChem
BindingDB:BDBM622025; PubChem:CID156873481
|
Local ready
Direct docking supported
|
|
E3L031184
BDB031184
|
US20230312542, Example 139
COc1cc(C(C(=O)N2C[C@H](O)C[C@H]2c2nc(C(=O)N3CCC(c4ccncc4)CC3)c[nH]2)C(C)C)on1
|
C27H34N6O5 522.606000 |
ZFHYOUKJWBZVKL-IRJALKPHSA-N | P40337 | von Hippel-Lindau disease tumor suppressor |
BindingDB, PubChem
BindingDB:BDBM622026; PubChem:CID156873391
|
Local ready
Direct docking supported
|
|
E3L031185
BDB031185
|
US20230312542, Example 140
COc1cc(C(C(=O)N2C[C@H](O)C[C@H]2c2nc(C(=O)N3CCN(c4ccccc4)CC3)c[nH]2)C(C)C)on1
|
C27H34N6O5 522.606000 |
YMVUQLBRSIEIPG-IRJALKPHSA-N | P40337 | von Hippel-Lindau disease tumor suppressor |
BindingDB, PubChem
BindingDB:BDBM622027; PubChem:CID156873246
|
Local ready
Direct docking supported
|
|
E3L031186
BDB031186
|
US20230312542, Example 141
COc1cc(C(C(=O)N2C[C@H](O)C[C@H]2c2nc(C(=O)N3CCC(OCc4ccccc4)CC3)c[nH]2)C(C)C)on1
|
C29H37N5O6 551.644000 |
ORIZQMGPUFNBBT-BITCVIISSA-N | P40337 | von Hippel-Lindau disease tumor suppressor |
BindingDB, PubChem
BindingDB:BDBM622028; PubChem:CID156873432
|
Local ready
Direct docking supported
|
|
E3L031187
BDB031187
|
US20230312542, Example 144
COc1cc(C(C(=O)N2C[C@H](O)C[C@H]2c2nc(C(=O)N3CCC(c4ccc(C)cn4)CC3)c[nH]2)C(C)C)on1
|
C28H36N6O5 536.633000 |
PFWQPQBISOYUHO-TUCIMNAFSA-N | P40337 | von Hippel-Lindau disease tumor suppressor |
BindingDB, PubChem
BindingDB:BDBM622029; PubChem:CID156873244
|
Local ready
Direct docking supported
|
|
E3L031188
BDB031188
|
US20230312542, Example 147
COc1cc(C(C(=O)N2C[C@H](O)C[C@H]2c2nc(C)cs2)C(C)C)on1
|
C17H23N3O4S 365.455000 |
KDRRPFRACAOPBC-ZVORSSOTSA-N | P40337 | von Hippel-Lindau disease tumor suppressor |
BindingDB, PubChem
BindingDB:BDBM622030; PubChem:CID156873368
|
Local ready
Direct docking supported
|
|
E3L031189
BDB031189
|
US20230312542, Example 148
COc1cc(C(C(=O)N2C[C@H](O)C[C@H]2c2nc(C(=O)N3CCCC(C(=O)Nc4ccccc4)C3)c[nH]2)C(C)C)on1
|
C29H36N6O6 564.643000 |
STECQCUHYTUUMQ-YCIRBCAISA-N | P40337 | von Hippel-Lindau disease tumor suppressor |
BindingDB, PubChem
BindingDB:BDBM622031; PubChem:CID156873494
|
Local ready
Direct docking supported
|
|
E3L031190
BDB031190
|
US20230312542, Example 150
COc1cc(C(C(=O)N2C[C@H](O)C[C@H]2c2nc(C(=O)N3CCC(Nc4ccccc4)CC3)c[nH]2)C(C)C)on1
|
C28H36N6O5 536.633000 |
JJHKPQUDUOZKKP-BOQQILRGSA-N | P40337 | von Hippel-Lindau disease tumor suppressor |
BindingDB, PubChem
BindingDB:BDBM622032; PubChem:CID156873365
|
Local ready
Direct docking supported
|
|
E3L031191
BDB031191
|
US20230312542, Example 153
COc1cc(C(C(=O)N2C[C@H](O)C[C@H]2c2nc(C(=O)N(C)Cc3ccc(-c4ccnc(C)c4)cc3)c[nH]2)C(C)C)on1
|
C31H36N6O5 572.666000 |
RBDFOFGIPCPCLM-WBUDJUEKSA-N | P40337 | von Hippel-Lindau disease tumor suppressor |
BindingDB, PubChem
BindingDB:BDBM622033; PubChem:CID156873376
|
Local ready
Direct docking supported
|
|
E3L031192
BDB031192
|
US20230312542, Example 154
COc1cc(C(C(=O)N2C[C@H](O)C[C@H]2c2nc(C(=O)N(C)Cc3ccc(-c4ccc(C)nc4)cc3)c[nH]2)C(C)C)on1
|
C31H36N6O5 572.666000 |
VDGASGGTLVYSKD-WBUDJUEKSA-N | P40337 | von Hippel-Lindau disease tumor suppressor |
BindingDB, PubChem
BindingDB:BDBM622034; PubChem:CID156873450
|
Local ready
Direct docking supported
|
|
E3L031193
BDB031193
|
US20230312542, Example 155
COc1cc(C(C(=O)N2C[C@H](O)C[C@H]2c2nc(C(=O)N(C)CC3CCN(Cc4ccccc4F)CC3)c[nH]2)C(C)C)on1
|
C31H41FN6O5 596.704000 |
VQQLIAAZYKFPII-NISFJFIFSA-N | P40337 | von Hippel-Lindau disease tumor suppressor |
BindingDB, PubChem
BindingDB:BDBM622035; PubChem:CID156873498
|
Local ready
Direct docking supported
|
|
E3L031194
BDB031194
|
US20230312542, Example 158
COc1cc(C(C(=O)N2C[C@H](O)C[C@H]2c2nc(C(=O)N(C)CCNc3ccccc3)c[nH]2)C(C)C)on1
|
C26H34N6O5 510.595000 |
FOXWVHVNFBOTSY-KPNPHKMBSA-N | P40337 | von Hippel-Lindau disease tumor suppressor |
BindingDB, PubChem
BindingDB:BDBM622036; PubChem:CID156873268
|
Local ready
Direct docking supported
|
|
E3L031195
BDB031195
|
US20230312542, Example 159
COc1cc(C(C(=O)N2C[C@H](O)C[C@H]2c2nc(C(=O)N(C)[C@H](C)C(=O)NCc3ccccc3)c[nH]2)C(C)C)on1
|
C28H36N6O6 552.632000 |
GBSCPFIQKLIOOX-UVZBPACESA-N | P40337 | von Hippel-Lindau disease tumor suppressor |
BindingDB, PubChem
BindingDB:BDBM622037; PubChem:CID156873250
|
Local ready
Direct docking supported
|
|
E3L031196
BDB031196
|
US20230312542, Example 160
Cc1cc(-c2cnn(C(C(=O)N3C[C@H](O)C[C@H]3c3ncc[nH]3)C(C)C)c2)on1
|
C19H24N6O3 384.440000 |
PGQWCKHGSZZHSD-CKDQBVIESA-N | P40337 | von Hippel-Lindau disease tumor suppressor |
BindingDB, PubChem
BindingDB:BDBM622038; PubChem:CID156873278
|
Local ready
Direct docking supported
|
|
E3L031197
BDB031197
|
US20230312542, Example 161
CCCc1nc(C(C(=O)N2C[C@H](O)C[C@H]2c2ncc[nH]2)C(C)C)no1
|
C17H25N5O3 347.419000 |
RPCAUYHTBIQUOA-RJTITELWSA-N | P40337 | von Hippel-Lindau disease tumor suppressor |
BindingDB, PubChem
BindingDB:BDBM622039; PubChem:CID156873449
|
Local ready
Direct docking supported
|
|
E3L031198
BDB031198
|
US20230312542, Example 162
CCCc1nnc(C(C(=O)N2C[C@H](O)C[C@H]2c2ncc[nH]2)C(C)C)o1
|
C17H25N5O3 347.419000 |
XIJQEVCNRXENLK-RJTITELWSA-N | P40337 | von Hippel-Lindau disease tumor suppressor |
BindingDB, PubChem
BindingDB:BDBM622040; PubChem:CID156873349
|
Local ready
Direct docking supported
|
|
E3L031199
BDB031199
|
BDBM625591
COc1cc(N2CCC(N3CCN(C)CC3)CC2)c(C)cc1Nc1ncc(Cl)c(Nc2ccc(C)cc2P(C)(C)=O)n1
|
C31H43ClN7O2P 612.159000 |
CDLKMKNNPYKLIR-UHFFFAOYSA-N | Q9HC35 | ALK tyrosine kinase receptor |
BindingDB, PubChem
BindingDB:BDBM625591; PubChem:CID166930810
|
Local ready
Direct docking supported
|
|
E3L031200
BDB031200
|
BDBM625592
COc1cc(N2CCC(N3CCN(C)CC3)CC2)c(C)cc1Nc1ncc(Br)c(Nc2ccc(C)cc2P(C)(C)=O)n1
|
C31H43BrN7O2P 656.610000 |
CFKDUEIETGGIRT-UHFFFAOYSA-N | Q9HC35 | ALK tyrosine kinase receptor |
BindingDB, PubChem
BindingDB:BDBM625592; PubChem:CID166930932
|
Local ready
Direct docking supported
|