| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L018641
BDB018641
|
BDBM443117
CN1CCN(c2ccc(Nc3nccc(N4CC(=O)NCC45CCCCC5)n3)nc2)CC1
|
C23H32N8O 436.564000 |
WYBDIAZRTPZHAJ-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM443117; PubChem:CID138595618
|
Local ready
Direct docking supported
|
|
E3L018642
BDB018642
|
BDBM443123
CN1CCN(c2ccc(Nc3nccc(N4C(c5ccccc5)=NCC45CCCCC5)n3)nc2)CC1
|
C28H34N8 482.636000 |
LHBYGETUNLHPQT-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM443123; PubChem:CID138595616
|
Local ready
Direct docking supported
|
|
E3L018643
BDB018643
|
BDBM443124
CN1CCN(c2ccc(Nc3nccc(N4C(c5ccoc5)=NCC45CCCCC5)n3)nc2)CC1
|
C26H32N8O 472.597000 |
YVKZJQMOPKJPBN-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM443124; PubChem:CID138595617
|
Local ready
Direct docking supported
|
|
E3L018644
BDB018644
|
BDBM443125
CN1CCN(c2ccc(Nc3nccc(N4C(c5ccsc5)=NCC45CCCCC5)n3)nc2)CC1
|
C26H32N8S 488.665000 |
UDQUHQJBHHLXTB-UHFFFAOYSA-N | P51948 | Cyclin-H |
BindingDB, PubChem
BindingDB:BDBM443125; PubChem:CID138595669
|
Local ready
Direct docking supported
|
|
E3L018645
BDB018645
|
US10654853, Example 1
N#CN1CCC2(Cc3ccccc3NC2=O)C1
|
C13H13N3O 227.267000 |
KZOIOGWZQUKLLJ-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443219; PubChem:CID137378609
|
Local ready
Direct docking supported
|
|
E3L018646
BDB018646
|
US10654853, Example 2
N#CN1CCC2(Cc3ccc(Cl)cc3NC2=O)C1
|
C13H12ClN3O 261.712000 |
SAYOSPYPKYVLRO-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443229; PubChem:CID137378564
|
Local ready
Direct docking supported
|
|
E3L018647
BDB018647
|
US10654853, Example 3
COc1ccc2c(c1)NC(=O)C1(CCN(C#N)C1)C2
|
C14H15N3O2 257.293000 |
IKSFNMDFWYUAPZ-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443230; PubChem:CID137378659
|
Local ready
Direct docking supported
|
|
E3L018648
BDB018648
|
US10654853, Example 4
N#CN1CCC2(Cc3ccc(-c4ccccc4)cc3NC2=O)C1
|
C19H17N3O 303.365000 |
GIEJCAPYJFXBFF-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443231; PubChem:CID137480043
|
Local ready
Direct docking supported
|
|
E3L018649
BDB018649
|
US10654853, Example 5
COc1ccc(C(C)C)cc1-c1ccc2c(c1)NC(=O)C1(CCN(C#N)C1)C2
|
C23H25N3O2 375.472000 |
GABPILKIYOKJHO-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443232; PubChem:CID137378660
|
Local ready
Direct docking supported
|
|
E3L018650
BDB018650
|
US10654853, Example 6
N#CN1CCC2(Cc3ccc(-c4ccc(-c5ccccc5)cc4)cc3NC2=O)C1
|
C25H21N3O 379.463000 |
BTEXBSRINXOICQ-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443233; PubChem:CID137378683
|
Local ready
Direct docking supported
|
|
E3L018651
BDB018651
|
US10654853, Example 7
N#CN1CCC2(Cc3ccc(-c4ccc(OCc5ccccc5)cc4)cc3NC2=O)C1
|
C26H23N3O2 409.489000 |
LHWGPTBOCHSNLR-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443234; PubChem:CID137479939
|
Local ready
Direct docking supported
|
|
E3L018652
BDB018652
|
US10654853, Example 8
Cc1ccc(F)c(-c2ccc3c(c2)NC(=O)C2(CCN(C#N)C2)C3)c1
|
C20H18FN3O 335.382000 |
WDCRZMDNYAREFO-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443235; PubChem:CID137479927
|
Local ready
Direct docking supported
|
|
E3L018653
BDB018653
|
US10654853, Example 9
N#Cc1cccc(-c2ccc3c(c2)NC(=O)C2(CCN(C#N)C2)C3)c1
|
C20H16N4O 328.375000 |
QSVFUTKXIARXKK-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443236; PubChem:CID137378601
|
Local ready
Direct docking supported
|
|
E3L018654
BDB018654
|
US10654853, Example 10
Cn1nccc1-c1ccc2c(c1)NC(=O)C1(CCN(C#N)C1)C2
|
C17H17N5O 307.357000 |
OZHVYCLOYQETBT-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443237; PubChem:CID137378672
|
Local ready
Direct docking supported
|
|
E3L018655
BDB018655
|
US10654853, Example 11
N#CN1CCC2(Cc3ccc(-c4ccc(Oc5ccccc5)cc4)cc3NC2=O)C1
|
C25H21N3O2 395.462000 |
JGVSDCTUYFHCOD-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443238; PubChem:CID137479958
|
Local ready
Direct docking supported
|
|
E3L018656
BDB018656
|
US10654853, Example 12
Cn1cc(-c2ccc3c(c2)NC(=O)C2(CCN(C#N)C2)C3)cn1
|
C17H17N5O 307.357000 |
SWYLXPPAIGBSJD-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443239; PubChem:CID137480007
|
Local ready
Direct docking supported
|
|
E3L018657
BDB018657
|
US10654853, Example 13
N#Cc1ccc(-c2ccc3c(c2)NC(=O)C2(CCN(C#N)C2)C3)cc1
|
C20H16N4O 328.375000 |
NCZWVROOUWKLNE-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443240; PubChem:CID137378576
|
Local ready
Direct docking supported
|
|
E3L018658
BDB018658
|
US10654853, Example 14
N#CN1CCC2(Cc3ccc(-c4cc(OC(F)(F)F)ccc4Cl)cc3NC2=O)C1
|
C20H15ClF3N3O2 421.806000 |
HORIVRDTRLQLHV-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443241; PubChem:CID137378577
|
Local ready
Direct docking supported
|
|
E3L018659
BDB018659
|
US10654853, Example 15
CNC(=O)c1ccc(-c2ccc3c(c2)NC(=O)C2(CCN(C#N)C2)C3)cn1
|
C20H19N5O2 361.405000 |
ORCWWINZVHVWDU-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443242; PubChem:CID137479996
|
Local ready
Direct docking supported
|
|
E3L018660
BDB018660
|
US10654853, Example 16
N#CN1CCC2(Cc3ccc(-c4ccccc4OCc4ccccc4)cc3NC2=O)C1
|
C26H23N3O2 409.489000 |
AZURDVSNWICSLJ-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443243; PubChem:CID137480021
|
Local ready
Direct docking supported
|