| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L018681
BDB018681
|
US10654853, Example 37
N#CN1CCC2(Cc3ccc(-c4ccc(C(=O)N5CCOCC5)cc4)cc3NC2=O)C1
|
C24H24N4O3 416.481000 |
DLTIJIMEGPKPNQ-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443264; PubChem:CID137479982
|
Local ready
Direct docking supported
|
|
E3L018682
BDB018682
|
US10654853, Example 38
N#CN1CCC2(Cc3ccc(-c4cccc(S(=O)(=O)N5CCOCC5)c4)cc3NC2=O)C1
|
C23H24N4O4S 452.536000 |
MMGDEKVOXDXWEK-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443265; PubChem:CID137378584
|
Local ready
Direct docking supported
|
|
E3L018683
BDB018683
|
US10654853, Example 39
Cn1cc(-c2ccc3c(c2)NC(=O)C2(CCN(C#N)C2)C3)ccc1=O
|
C19H18N4O2 334.379000 |
FCNZSNJQHGUSHC-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443266; PubChem:CID137378572
|
Local ready
Direct docking supported
|
|
E3L018684
BDB018684
|
US10654853, Example 40
Cc1nc2cc(-c3ccc4c(c3)NC(=O)C3(CCN(C#N)C3)C4)ccc2s1
|
C21H18N4OS 374.469000 |
BXSJRMRPWOXVHC-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443267; PubChem:CID137378550
|
Local ready
Direct docking supported
|
|
E3L018685
BDB018685
|
US10654853, Example 41
N#CN1CCC2(Cc3cc(-c4ccccc4)ccc3NC2=O)C1
|
C19H17N3O 303.365000 |
JJRODOFXOSSRAM-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443268; PubChem:CID137378619
|
Local ready
Direct docking supported
|
|
E3L018686
BDB018686
|
US10654853, Example 42
N#Cc1ccc(-c2ccc3c(c2)CC2(CCN(C#N)C2)C(=O)N3)cc1
|
C20H16N4O 328.375000 |
NFLKIORMAFZRSR-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443269; PubChem:CID137378639
|
Local ready
Direct docking supported
|
|
E3L018687
BDB018687
|
US10654853, Example 43
N#Cc1cccc(-c2ccc3c(c2)CC2(CCN(C#N)C2)C(=O)N3)c1
|
C20H16N4O 328.375000 |
IQIHWZWUMFLBRA-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443270; PubChem:CID137378636
|
Local ready
Direct docking supported
|
|
E3L018688
BDB018688
|
US10654853, Example 45
N#CN1CCC2(Cc3cc(-c4cccc(F)c4)ccc3NC2=O)C1
|
C19H16FN3O 321.355000 |
ACLVQLXJKJDMIR-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443272; PubChem:CID137479947
|
Local ready
Direct docking supported
|
|
E3L018689
BDB018689
|
US10654853, Example 46
CN(C)C(=O)c1ccc2c(c1)NC(=O)C1(CCN(C#N)C1)C2
|
C16H18N4O2 298.346000 |
VQNIFRUAGGWIJA-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443273; PubChem:CID137479963
|
Local ready
Direct docking supported
|
|
E3L018690
BDB018690
|
US10654853, Example 47
CNC(=O)c1ccc2c(c1)NC(=O)C1(CCN(C#N)C1)C2
|
C15H16N4O2 284.319000 |
KOYWQFDRXLZVTO-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443274; PubChem:CID137479925
|
Local ready
Direct docking supported
|
|
E3L018691
BDB018691
|
US10654853, Example 48
N#CN1CCC2(C1)Oc1ncccc1NC2=O
|
C11H10N4O2 230.227000 |
VNNWQCNZXZGJPE-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443275; PubChem:CID137378653
|
Local ready
Direct docking supported
|
|
E3L018692
BDB018692
|
US10654853, Example 49
N#CN1CCC2(C1)Oc1ncc(-c3ccccc3)cc1NC2=O
|
C17H14N4O2 306.325000 |
MKBZOPTVVUKRGE-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443276; PubChem:CID137480019
|
Local ready
Direct docking supported
|
|
E3L018693
BDB018693
|
US10654853, Example 50
N#Cc1ccc(-c2cnc3c(c2)NC(=O)C2(CCN(C#N)C2)O3)cc1
|
C18H13N5O2 331.335000 |
AUYFWPWADNCLMC-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443277; PubChem:CID137479945
|
Local ready
Direct docking supported
|
|
E3L018694
BDB018694
|
US10654853, Example 51
N#Cc1cccc(-c2cnc3c(c2)NC(=O)C2(CCN(C#N)C2)O3)c1
|
C18H13N5O2 331.335000 |
IRUHFBNMGVZHQG-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443278; PubChem:CID137479919
|
Local ready
Direct docking supported
|
|
E3L018695
BDB018695
|
US10654853, Example 52
N#CN1CCC2(C1)Oc1ncc(-c3ccc(F)cc3)cc1NC2=O
|
C17H13FN4O2 324.315000 |
HLYCKDSIIMKHFL-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443279; PubChem:CID137480015
|
Local ready
Direct docking supported
|
|
E3L018696
BDB018696
|
US10654853, Example 53
N#CN1CCC2(C1)Oc1ncc(-c3cccc(F)c3)cc1NC2=O
|
C17H13FN4O2 324.315000 |
WWIKEUVTLWVECX-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443280; PubChem:CID137479920
|
Local ready
Direct docking supported
|
|
E3L018697
BDB018697
|
US10654853, Example 54
N#CN1CCC2(C1)Oc1nc(-c3ccccc3)ccc1NC2=O
|
C17H14N4O2 306.325000 |
ADBCOBFTXNWWHQ-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443281; PubChem:CID137479985
|
Local ready
Direct docking supported
|
|
E3L018698
BDB018698
|
US10654853, Example 55
N#CN1CCC2(C1)Nc1ncccc1NC2=O
|
C11H11N5O 229.243000 |
QSVNEFGIDRZGEW-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443282; PubChem:CID137480003
|
Local ready
Direct docking supported
|
|
E3L018699
BDB018699
|
US10654853, Example 56
N#CN1CCC2(C1)Nc1nc(C(F)(F)F)ccc1NC2=O
|
C12H10F3N5O 297.240000 |
ZWXNQXPVMSIGMU-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443283; PubChem:CID137479966
|
Local ready
Direct docking supported
|
|
E3L018700
BDB018700
|
US10654853, Example 57
N#CN1CCC2(C1)Nc1ncc(-c3ccccc3)cc1NC2=O
|
C17H15N5O 305.341000 |
GTBXEQCNEFSZRE-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443284; PubChem:CID137479957
|
Local ready
Direct docking supported
|