| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L035161
BDB035161
|
US20240409538, Example 6
COc1ncnc(C2CC2)c1-c1nc2c(Cc3ccc(-n4nc(C(F)(F)F)cc4C)cc3)cccn2n1
|
C26H22F3N7O 505.504000 |
IJKSUTNQNUJWPY-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707413; PubChem:CID171782556
|
Local ready
Direct docking supported
|
|
E3L035162
BDB035162
|
US20240409538, Example 14
COc1ncnc(C2CC2)c1-c1nc2cccc(Cc3ccc(-c4nc(C(F)(F)F)cn4C)cc3)n2n1
|
C26H22F3N7O 505.504000 |
BKILQNHKHNOVSC-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707414; PubChem:CID171782536
|
Local ready
Direct docking supported
|
|
E3L035163
BDB035163
|
US20240409538, Example 15
Cc1cnn(C(C)C)c1-c1nc2cccc(Cc3ccc(-c4nc(C(F)(F)F)cn4C)cc3)n2n1
|
C25H24F3N7 479.510000 |
UHWZNKIVDVUZMO-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707415; PubChem:CID171782528
|
Local ready
Direct docking supported
|
|
E3L035164
BDB035164
|
US20240409538, Example 16
Cc1cnn(C(C)C)c1-c1nc2c(Cc3ccc(-c4nc(C(F)(F)F)cn4C)cc3)cccn2n1
|
C25H24F3N7 479.510000 |
LXTYKGGKBWVQSD-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707416; PubChem:CID171782514
|
Local ready
Direct docking supported
|
|
E3L035165
BDB035165
|
US20240409538, Example 18
COc1ncnc(C2CC2)c1-c1nc2c(Cc3ccc(-c4nc(C(F)(F)F)cn4C)cc3)nccn2n1
|
C25H21F3N8O 506.492000 |
NSMMZONEFKOTRR-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707417; PubChem:CID170157103
|
Local ready
Direct docking supported
|
|
E3L035166
BDB035166
|
US20240409538, Example 19
COc1ncnc(C2CC2)c1-c1nc2c(Cc3ccc(-c4nc(C(F)(F)F)cn4C)cc3)cncn2n1
|
C25H21F3N8O 506.492000 |
TYVAKAPNHXZPNO-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707418; PubChem:CID171782555
|
Local ready
Direct docking supported
|
|
E3L035167
BDB035167
|
US20240409538, Example 21
COc1ncnc(C2CC2)c1-c1nc2ccnc(Cc3ccc(-c4nc(C(F)(F)F)cn4C)cc3)n2n1
|
C25H21F3N8O 506.492000 |
FICIBGGHGXMISN-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707419; PubChem:CID171782521
|
Local ready
Direct docking supported
|
|
E3L035168
BDB035168
|
US20240409538, Example 22
COc1ncnc(C2CC2)c1-c1nc2cncc(Cc3ccc(-c4nc(C(F)(F)F)cn4C)cc3)n2n1
|
C25H21F3N8O 506.492000 |
WZZWZPLFQODTBF-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707420; PubChem:CID171782552
|
Local ready
Direct docking supported
|
|
E3L035169
BDB035169
|
US20240409538, Example 23
COc1ncnc(C2CC2)c1-c1nc2nccc(Cc3ccc(-c4nc(C(F)(F)F)cn4C)cc3)n2n1
|
C25H21F3N8O 506.492000 |
ZFIFFTGDPPIGAC-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707421; PubChem:CID171782530
|
Local ready
Direct docking supported
|
|
E3L035170
BDB035170
|
US20240409538, Example 24
COc1ncnc(C2CC2)c1-c1nc2c(Cc3ccc(-c4nc(C(F)(F)F)cn4C4CC4)cc3)cccn2n1
|
C28H24F3N7O 531.542000 |
YLSDAPHTULWYFG-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707422; PubChem:CID171782531
|
Local ready
Direct docking supported
|
|
E3L035171
BDB035171
|
US20240409538, Example 25
COc1ncnc(C2CC2)c1-c1nc2c(Cc3ccc(-c4nc(C(F)(F)F)cn4C)c(F)c3)cccn2n1
|
C26H21F4N7O 523.494000 |
KHOQREVRBZGBHO-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707423; PubChem:CID171782513
|
Local ready
Direct docking supported
|
|
E3L035172
BDB035172
|
US20240409538, Example 26
CCn1cc(C(F)(F)F)nc1-c1c(F)cc(Cc2cccn3nc(-c4c(OC)ncnc4C4CC4)nc23)cc1OC
|
C28H25F4N7O2 567.547000 |
CPLNQBDFWYAGLD-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707424; PubChem:CID171782544
|
Local ready
Direct docking supported
|
|
E3L035173
BDB035173
|
US20240409538, Example 27
COc1ncnc(OC)c1-c1nc2c(Cc3ccc(-c4nc(C(F)(F)F)cn4C)cc3)cccn2n1
|
C24H20F3N7O2 495.465000 |
GORFRRGOHVPCJV-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707425; PubChem:CID171782533
|
Local ready
Direct docking supported
|
|
E3L035174
BDB035174
|
US20240409538, Example 28
COc1ncnc(C2CCC2)c1-c1nc2c(Cc3ccc(-c4nc(C(F)(F)F)cn4C)cc3)cccn2n1
|
C27H24F3N7O 519.531000 |
KEUAKHIANHEVGN-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707426; PubChem:CID171782518
|
Local ready
Direct docking supported
|
|
E3L035175
BDB035175
|
US20240409538, Example 29
COc1ncnc(C2CC2)c1-c1nc2c(Cc3ccc(-c4nc(C(F)(F)F)cn4C4CC4)cc3)nccn2n1
|
C27H23F3N8O 532.530000 |
WBPKXLBYBXRJRQ-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707427; PubChem:CID171782543
|
Local ready
Direct docking supported
|
|
E3L035176
BDB035176
|
US20240409538, Example 30
COc1ncnc(C2CC2)c1-c1nc2c(Cc3ccc(-c4nc(C(F)(F)F)cn4C)c(F)c3)nccn2n1
|
C25H20F4N8O 524.482000 |
BHLBVXTZBWFDPD-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707428; PubChem:CID171782553
|
Local ready
Direct docking supported
|
|
E3L035177
BDB035177
|
US20240409538, Example 31
CCn1cc(C(F)(F)F)nc1-c1c(F)cc(Cc2nccn3nc(-c4c(OC)ncnc4C4CC4)nc23)cc1F
|
C26H21F5N8O 556.499000 |
WQMQLZUNOZOGQG-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707429; PubChem:CID171782525
|
Local ready
Direct docking supported
|
|
E3L035178
BDB035178
|
US20240409538, Example 32
COc1ncnc(C2CC2)c1-c1nc2c(Cc3ccc(-c4nc(C(F)(F)F)cn4C4CC4)cc3)cncn2n1
|
C27H23F3N8O 532.530000 |
BCEBCCYHAPCTHG-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707430; PubChem:CID171782554
|
Local ready
Direct docking supported
|
|
E3L035179
BDB035179
|
US20240409538, Example 33
COc1ncnc(C2CC2)c1-c1nc2c(Cc3ccc(-c4nc(C(F)(F)F)cn4C)c(F)c3)cncn2n1
|
C25H20F4N8O 524.482000 |
DMWKCYJIXZYREF-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707431; PubChem:CID171782517
|
Local ready
Direct docking supported
|
|
E3L035180
BDB035180
|
US20240409538, Example 34
CCn1cc(C(F)(F)F)nc1-c1c(F)cc(Cc2cncn3nc(-c4c(OC)ncnc4C4CC4)nc23)cc1F
|
C26H21F5N8O 556.499000 |
PEGWTKVLVNXKHH-UHFFFAOYSA-N | Q8TAF3 | Ubiquitin carboxyl-terminal hydrolase 1 |
BindingDB, PubChem
BindingDB:BDBM707432; PubChem:CID171782561
|
Local ready
Direct docking supported
|