| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L019881
BDB019881
|
US10844044, Example 197
CCn1cc(-c2cc(Cn3ccn(C4CC4)c3=N)cc(C(=O)NCc3ccc(F)c(C)c3)c2)c(C(F)(F)F)n1
|
C28H28F4N6O 540.565000 |
JDDQROKCFHICFG-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473249; PubChem:CID146455700
|
Local ready
Direct docking supported
|
|
E3L019882
BDB019882
|
US10844044, Example 289
CCn1cc(-c2cc(CN3CCOC3=N)cc(C(=O)NCC3CCCO3)c2)c(C(F)(F)F)n1
|
C22H26F3N5O3 465.476000 |
XNZLNPLIUJBCMN-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473250; PubChem:CID146455943
|
Local ready
Direct docking supported
|
|
E3L019883
BDB019883
|
US10844044, Example 16
Cc1cc(CNC(=O)c2cc(Cn3ccn(C)c3=N)cc(-c3ccncc3C)c2)ccc1Cl
|
C26H26ClN5O 459.981000 |
RTXXOMJYDBCZNP-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473251; PubChem:CID146456004
|
Local ready
Direct docking supported
|
|
E3L019884
BDB019884
|
US10844044, Example 107
Cc1cc([C@@H](NC(=O)c2cc(Cn3ccn(C)c3=N)cc(-c3ccc(F)cc3C(F)(F)F)n2)C2CC2)ccc1F
|
C29H26F5N5O 555.551000 |
AKKWACFBGWEIPJ-SANMLTNESA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473252; PubChem:CID146456190
|
Local ready
Direct docking supported
|
|
E3L019885
BDB019885
|
US10844044, Example 198
CCn1cc(-c2cc(Cn3ccn(C)c3=N)cc(C(=O)NCc3ccc(F)c(C)c3)c2)c(C(F)(F)F)n1
|
C26H26F4N6O 514.527000 |
CKCSDCHTLXSCGT-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473253; PubChem:CID146456423
|
Local ready
Direct docking supported
|
|
E3L019886
BDB019886
|
US10844044, Example 290
CCn1cc(-c2cc(CN3CCOC3=N)cc(C(=O)NCC3CCOC3)c2)c(C(F)(F)F)n1
|
C22H26F3N5O3 465.476000 |
DCFAKXBACIFGKK-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473254; PubChem:CID146456071
|
Local ready
Direct docking supported
|
|
E3L019887
BDB019887
|
US10844044, Example 17
Cc1cc(CNC(=O)c2cc(Cn3ccn(C)c3=N)cc(-c3ccnn3C)c2)ccc1Cl
|
C24H25ClN6O 448.958000 |
VVBGZQAPLNVLMF-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473255; PubChem:CID146456084
|
Local ready
Direct docking supported
|
|
E3L019888
BDB019888
|
US10844044, Example 108
COc1cc(CNC(=O)c2cc(Cn3ccn(C)c3=N)cc(-c3ccc(F)cc3C(F)(F)F)c2F)cc(OC)c1
|
C28H25F5N4O3 560.523000 |
VWZAGEVGWUQNJL-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473256; PubChem:CID146456199
|
Local ready
Direct docking supported
|
|
E3L019889
BDB019889
|
US10844044, Example 199
CCn1cc(-c2cc(Cn3ccn(C4CC4)c3=N)cc(C(=O)NCc3ccc(=O)n(C)c3)c2)c(C(F)(F)F)n1
|
C27H28F3N7O2 539.562000 |
LGXXBAMZIVGJEP-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473257; PubChem:CID146455776
|
Local ready
Direct docking supported
|
|
E3L019890
BDB019890
|
US10844044, Example 291
Cc1cc([C@@H](NC(=O)c2cc(Cn3ccoc3=N)cc(-c3cn(C(C)C)nc3C(F)(F)F)c2)C2CC2)ccc1F
|
C29H29F4N5O2 555.576000 |
MFKPRJPANTWPHT-VWLOTQADSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473258; PubChem:CID146456667
|
Local ready
Direct docking supported
|
|
E3L019891
BDB019891
|
US10844044, Example 18
Cc1cc(-c2cc(Cn3ccn(C)c3=N)cc(C(=O)NCc3ccc(Cl)c(C)c3)c2)ccn1
|
C26H26ClN5O 459.981000 |
FFELOLPQYKXVQJ-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473259; PubChem:CID146456654
|
Local ready
Direct docking supported
|
|
E3L019892
BDB019892
|
US10844044, Example 109
Cc1cc([C@@H](NC(=O)c2cc(Cn3ccn(C)c3=N)cc(-c3ccc(F)cc3C(F)(F)F)c2F)C2CC2)ccc1F
|
C30H26F6N4O 572.553000 |
NGCXKJBNAVLJAI-MHZLTWQESA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473260; PubChem:CID146456475
|
Local ready
Direct docking supported
|
|
E3L019893
BDB019893
|
US10844044, Example 200
CCn1cc(-c2cc(Cn3ccn(C)c3=N)cc(C(=O)NCc3ccc(=O)n(C)c3)c2)c(C(F)(F)F)n1
|
C25H26F3N7O2 513.524000 |
XDGKYFOWXFYLKC-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473261; PubChem:CID146456402
|
Local ready
Direct docking supported
|
|
E3L019894
BDB019894
|
US10844044, Example 292
CCn1cc(-c2cc(Cn3ccoc3=N)cc(C(=O)NCc3ccc(=O)n(C)c3)c2)c(C(F)(F)F)n1
|
C24H23F3N6O3 500.481000 |
FVGWTRMTJJJDQO-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473262; PubChem:CID146456133
|
Local ready
Direct docking supported
|
|
E3L019895
BDB019895
|
US10844044, Example 19
Cc1cc(CNC(=O)c2cc(Cn3cc[nH]c3=N)cc(-c3cccn3C)c2)ccc1Cl
|
C24H24ClN5O 433.943000 |
SCKVLJFPQFKGDA-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473263; PubChem:CID146457041
|
Local ready
Direct docking supported
|
|
E3L019896
BDB019896
|
US10844044, Example 110
COC(=O)CC(NC(=O)c1cc(Cn2ccn(C)c2=N)cc(-c2ccc(F)cc2C(F)(F)F)c1F)c1ccc(Cl)c(Cl)c1
|
C29H23Cl2F5N4O3 641.424000 |
BAEBGXJRILNWDE-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473264; PubChem:CID146455927
|
Local ready
Direct docking supported
|
|
E3L019897
BDB019897
|
US10844044, Example 201
Cc1cc([C@@H](NC(=O)c2cc(Cn3ccn(C)c3=N)cc(-c3ccccc3C)c2)C2CC2)ccc1F
|
C30H31FN4O 482.603000 |
STFMCBSGCNEJKN-NDEPHWFRSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473265; PubChem:CID146456544
|
Local ready
Direct docking supported
|
|
E3L019898
BDB019898
|
US10844044, Example 293
CCn1cc(-c2cc(CN3CCOC3=N)cc(C(=O)NCc3ccc(=O)n(C)c3)c2)c(C(F)(F)F)n1
|
C24H25F3N6O3 502.497000 |
NRLVHJIGDXLTNU-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473266; PubChem:CID146455766
|
Local ready
Direct docking supported
|
|
E3L019899
BDB019899
|
US10844044, Example 20
COc1cnccc1-c1cc(Cn2ccn(C)c2=N)cc(C(=O)NCc2ccc(Cl)c(C)c2)c1
|
C26H26ClN5O2 475.980000 |
FMTWGZGNAPSFOS-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473267; PubChem:CID146455835
|
Local ready
Direct docking supported
|
|
E3L019900
BDB019900
|
US10844044, Example 111
Cc1cc(CNC(=O)c2cc(Cn3ccn(C)c3=N)cc(-c3ccc(F)cc3C(F)(F)F)c2F)ccc1Cl
|
C27H22ClF5N4O 548.943000 |
JRTJHGXDXCATKI-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473268; PubChem:CID146456593
|
Local ready
Direct docking supported
|