| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L018761
BDB018761
|
US10654853, Example 119
CC(=O)Nc1ccccc1-c1ccc2c(c1)CC1(CCN(C#N)C1)C(=O)N2
|
C21H20N4O2 360.417000 |
FVPCYEDRHMZEGW-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443346; PubChem:CID137378594
|
Local ready
Direct docking supported
|
|
E3L018762
BDB018762
|
US10654853, Example 120
N#CN1CCC2(Cc3cc(-c4ccc(C(=O)N5CCOCC5)cc4)ccc3NC2=O)C1
|
C24H24N4O3 416.481000 |
OJPIRCLHWDRREC-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443347; PubChem:CID137479975
|
Local ready
Direct docking supported
|
|
E3L018763
BDB018763
|
US10654853, Example 121
N#CN1CCC2(Cc3cc(-c4cccc(S(=O)(=O)N5CCOCC5)c4)ccc3NC2=O)C1
|
C23H24N4O4S 452.536000 |
UUHPZBKRZQBSHZ-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443348; PubChem:CID137378625
|
Local ready
Direct docking supported
|
|
E3L018764
BDB018764
|
US10654853, Example 122
Cn1cc(-c2ccc3c(c2)CC2(CCN(C#N)C2)C(=O)N3)ccc1=O
|
C19H18N4O2 334.379000 |
FHAQTIUAPGEIQK-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443349; PubChem:CID137378583
|
Local ready
Direct docking supported
|
|
E3L018765
BDB018765
|
US10654853, Example 123
Cc1nc2cc(-c3ccc4c(c3)CC3(CCN(C#N)C3)C(=O)N4)ccc2s1
|
C21H18N4OS 374.469000 |
INHRDLUVKVXEFT-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443350; PubChem:CID137378592
|
Local ready
Direct docking supported
|
|
E3L018766
BDB018766
|
US10654853, Example 124
Cc1noc(C)c1-c1ccc2c(c1)CC1(CCN(C#N)C1)C(=O)N2
|
C18H18N4O2 322.368000 |
UBGWJHKEPWEAHM-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443351; PubChem:CID137378574
|
Local ready
Direct docking supported
|
|
E3L018767
BDB018767
|
US10654853, Example 125
N#CN1CCC2(Cc3cc(-c4cc(OC(F)(F)F)ccc4Cl)ccc3NC2=O)C1
|
C20H15ClF3N3O2 421.806000 |
XOVJWWGPMBQSLT-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443352; PubChem:CID137479934
|
Local ready
Direct docking supported
|
|
E3L018768
BDB018768
|
US10654853, Example 126
CN1CCN(c2ccc(-c3ccc4c(c3)CC3(CCN(C#N)C3)C(=O)N4)cc2)CC1
|
C24H27N5O 401.514000 |
CFCHWWXDCMMRTQ-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443353; PubChem:CID137378562
|
Local ready
Direct docking supported
|
|
E3L018769
BDB018769
|
US10654853, Example 127
N#CN1CCC2(Cc3cc(-c4ccc(C(=O)NCc5ccccc5)cc4)ccc3NC2=O)C1
|
C27H24N4O2 436.515000 |
JIEOYVVPGAVNRA-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443354; PubChem:CID137479948
|
Local ready
Direct docking supported
|
|
E3L018770
BDB018770
|
BDBM443355
Cc1n[nH]cc1-c1ccc2c(c1)CC1(CCN(C#N)C1)C(=O)N2
|
C17H17N5O 307.357000 |
LWSLYMICCJLISF-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443355; PubChem:CID137479956
|
Local ready
Direct docking supported
|
|
E3L018771
BDB018771
|
US10654853, Example 129
N#CN1CCC2(Cc3cc(-c4ccc(CN5CCOCC5)cc4)ccc3NC2=O)C1
|
C24H26N4O2 402.498000 |
ZXHCRZMGHWGSKM-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443356; PubChem:CID137378596
|
Local ready
Direct docking supported
|
|
E3L018772
BDB018772
|
US10654853, Example 130
CN(C)C(=O)c1cccc(-c2ccc(-c3ccc4c(c3)CC3(CCN(C#N)C3)C(=O)N4)cc2)c1
|
C28H26N4O2 450.542000 |
GZWGPOBPWLYJDW-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443357; PubChem:CID155490021
|
Local ready
Direct docking supported
|
|
E3L018773
BDB018773
|
US10654853, Example 131
N#CN1CCC2(Cc3cc(-c4ccncc4)ccc3NC2=O)C1
|
C18H16N4O 304.353000 |
SKKUSKSAJSFSHE-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443358; PubChem:CID155490022
|
Local ready
Direct docking supported
|
|
E3L018774
BDB018774
|
US10654853, Example 132
Cc1ccc2[nH]ncc2c1-c1ccc2c(c1)NC(=O)[C@@]1(CCN(C#N)C1)C2
|
C21H19N5O 357.417000 |
KDZWETVEPVDWCE-NRFANRHFSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443359; PubChem:CID137378643
|
Local ready
Direct docking supported
|
|
E3L018775
BDB018775
|
US10654853, Example 133
N#CN1CCC2(Cc3ccc(-c4cccc5[nH]ncc45)cc3NC2=O)C1
|
C20H17N5O 343.390000 |
SNEYCKLYNHQRKM-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443360; PubChem:CID137378581
|
Local ready
Direct docking supported
|
|
E3L018776
BDB018776
|
US10654853, Example 134
N#CN1CCC2(Cc3cc(-c4cccc5[nH]ncc45)ccc3NC2=O)C1
|
C20H17N5O 343.390000 |
YDVWMYPUVSXYTM-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443361; PubChem:CID137378606
|
Local ready
Direct docking supported
|
|
E3L018777
BDB018777
|
BDBM443362
N#CN1CCC2(C1)Oc1ncc(-c3cccc4[nH]ncc34)cc1NC2=O
|
C18H14N6O2 346.350000 |
BQQJOPMEEYFNJZ-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443362; PubChem:CID137479993
|
Local ready
Direct docking supported
|
|
E3L018778
BDB018778
|
US10654853, Example 136
Cn1ncc2c(-c3cnc4c(c3)NC(=O)C3(CCN(C#N)C3)O4)cccc21
|
C19H16N6O2 360.377000 |
QJGVWJHPIXHZOH-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443363; PubChem:CID137480030
|
Local ready
Direct docking supported
|
|
E3L018779
BDB018779
|
US10654853, Example 137
CCn1ncc2c(-c3cnc4c(c3)NC(=O)C3(CCN(C#N)C3)O4)cccc21
|
C20H18N6O2 374.404000 |
RTOQOOGELQCCQZ-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443364; PubChem:CID155490024
|
Local ready
Direct docking supported
|
|
E3L018780
BDB018780
|
US10654853, Example 138
COc1ccc(-c2cnc3c(c2)NC(=O)C2(CCN(C#N)C2)O3)c(C)n1
|
C18H17N5O3 351.366000 |
LXBSTCDUYMGEOO-UHFFFAOYSA-N | Q6GQQ9 | OTU domain-containing protein 7B |
BindingDB, PubChem
BindingDB:BDBM443365; PubChem:CID137480017
|
Local ready
Direct docking supported
|