| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L020061
BDB020061
|
US10844044, Example 152
COc1cc(CNC(=O)c2cc(CN3CCN(C)C3=N)cc(-c3ccc(F)cc3C(N)=O)c2)cc(OC)c1
|
C28H30FN5O4 519.577000 |
BPAWGPCRDIVHJR-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473437; PubChem:CID146488137
|
Local ready
Direct docking supported
|
|
E3L020062
BDB020062
|
US10844044, Example 243
Cc1cc([C@@H](NC(=O)c2cc(Cn3ccoc3=N)cc(-c3cccnc3C(F)(F)F)c2)C2CC2)ccc1F
|
C28H24F4N4O2 524.518000 |
GWWDUHVBMCFSGI-DEOSSOPVSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473438; PubChem:CID146456689
|
Local ready
Direct docking supported
|
|
E3L020063
BDB020063
|
US10844044, Example 336
Cc1cc([C@@H](NC(=O)c2cc(CN3CCCC3=N)cc(-c3cn(C(C)C)nc3C(F)(F)F)c2)C2CC2)ccc1F
|
C30H33F4N5O 555.620000 |
PQZMAGZYXLBTIG-MHZLTWQESA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473439; PubChem:CID146455830
|
Local ready
Direct docking supported
|
|
E3L020064
BDB020064
|
US10844044, Example 62
COc1cc(CNC(=O)c2cc(Cn3ccn(C)c3=N)cc(-c3ccc(F)cc3OC(F)F)c2)cc(OC)c1
|
C28H27F3N4O4 540.542000 |
AWOCAJBZUOFJRD-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473440; PubChem:CID146455800
|
Local ready
Direct docking supported
|
|
E3L020065
BDB020065
|
US10844044, Example 153
Cn1ccn(Cc2cc(C(=O)N[C@H](c3ccc(Cl)c(Cl)c3)C3CC3)cc(-c3cccnc3C(F)(F)F)c2)c1=N
|
C28H24Cl2F3N5O 574.434000 |
GKPIIXJEQYEOKD-DEOSSOPVSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473441; PubChem:CID146455894
|
Local ready
Direct docking supported
|
|
E3L020066
BDB020066
|
US10844044, Example 244
COc1cc(CNC(=O)c2cc(Cn3ccoc3=N)cc(-c3cccnc3C(F)(F)F)c2)cc(OC)c1
|
C26H23F3N4O4 512.488000 |
WJMWNKWEATWYRG-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473442; PubChem:CID146455820
|
Local ready
Direct docking supported
|
|
E3L020067
BDB020067
|
US10844044, Example 337
Cc1cc([C@@H](NC(=O)c2cc(CN3CCCC3=N)cc(-c3cn(C)nc3C(F)(F)F)c2)C2CC2)ccc1F
|
C28H29F4N5O 527.566000 |
LOOUMNIFSXYYJY-VWLOTQADSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473443; PubChem:CID146455937
|
Local ready
Direct docking supported
|
|
E3L020068
BDB020068
|
US10844044, Example 63
COc1cc(OC)cc(C(NC(=O)c2cc(Cn3ccn(C)c3=N)cc(-c3ccc(F)cc3OC(F)F)c2)C2CC2)c1
|
C31H31F3N4O4 580.607000 |
UPYQUJZTFXEWMR-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473444; PubChem:CID146455833
|
Local ready
Direct docking supported
|
|
E3L020069
BDB020069
|
US10844044, Example 154
Cc1cc([C@@H](NC(=O)c2cc(Cn3ccn(C)c3=N)cc(-c3ccc(F)cc3C(F)F)c2)C2CC2)ccc1F
|
C30H28F4N4O 536.573000 |
FKEDSTGSVSSBBI-MHZLTWQESA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473445; PubChem:CID146455769
|
Local ready
Direct docking supported
|
|
E3L020070
BDB020070
|
US10844044, Example 245
COc1cc(OC)cc(C(NC(=O)c2cc(Cn3ccoc3=N)cc(-c3cccnc3C(F)(F)F)c2)C2CC2)c1
|
C29H27F3N4O4 552.553000 |
WTIDKCAWSGFSIE-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473446; PubChem:CID146456869
|
Local ready
Direct docking supported
|
|
E3L020071
BDB020071
|
US10844044, Example 338
CCn1cc(-c2cc(CN3CCCC3=N)cc(C(=O)N[C@H](c3ccc(F)c(Cl)c3)C3CC3)c2)c(C(F)(F)F)n1
|
C28H28ClF4N5O 562.011000 |
GBODVALIPVDSSV-VWLOTQADSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473447; PubChem:CID146455736
|
Local ready
Direct docking supported
|
|
E3L020072
BDB020072
|
US10844044, Example 64
Cc1cc([C@@H](NC(=O)c2cc(Cn3ccn(C)c3=N)cc(-c3ncccc3C(F)(F)F)c2)C2CC2)ccc1F
|
C29H27F4N5O 537.561000 |
TTWKUXCHTKWRNP-VWLOTQADSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473448; PubChem:CID146455933
|
Local ready
Direct docking supported
|
|
E3L020073
BDB020073
|
US10844044, Example 155
N=c1n(Cc2cc(C(=O)N[C@H](c3ccc(Cl)c(Cl)c3)C3CC3)cc(-c3cccnc3C(F)(F)F)c2)ccn1C1CC1
|
C30H26Cl2F3N5O 600.472000 |
VLPHQBIZSYBWOX-SANMLTNESA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473449; PubChem:CID146455760
|
Local ready
Direct docking supported
|
|
E3L020074
BDB020074
|
US10844044, Example 246
Cc1cc(F)ccc1-c1cc(Cn2ccoc2=N)cc(C(=O)NCc2ccc(F)cc2)c1
|
C25H21F2N3O2 433.458000 |
GTHLFECYAKIOBB-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473450; PubChem:CID146455771
|
Local ready
Direct docking supported
|
|
E3L020075
BDB020075
|
US10844044, Example 339
COc1cc([C@@H](NC(=O)c2cc(CN3CCCC3=N)cc(-c3cn(C)nc3C(F)(F)F)c2)C2CC2)ccc1F
|
C28H29F4N5O2 543.565000 |
MOGMWQNFULMKHJ-VWLOTQADSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473451; PubChem:CID146455877
|
Local ready
Direct docking supported
|
|
E3L020076
BDB020076
|
US10844044, Example 65
COc1cc(CNC(=O)c2cc(Cn3ccn(C)c3=N)cc(-c3c(C)cc(F)cc3C)c2)cc(OC)c1
|
C29H31FN4O3 502.590000 |
XJZNKYPGIBYVEP-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473452; PubChem:CID146456911
|
Local ready
Direct docking supported
|
|
E3L020077
BDB020077
|
US10844044, Example 156
Cc1cc([C@@H](NC(=O)c2cc(Cn3ccn(C4CC4)c3=N)cc(-c3ccc(F)cc3OC(F)F)c2)C2CC2)ccc1F
|
C32H30F4N4O2 578.610000 |
LEQVYIWJXDYGSU-LJAQVGFWSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473453; PubChem:CID146457664
|
Local ready
Direct docking supported
|
|
E3L020078
BDB020078
|
US10844044, Example 247
Cc1ccnc([C@@H](NC(=O)c2cc(Cn3ccoc3=N)cc(-c3ccc(F)cc3C)c2)C2CC2)c1
|
C28H27FN4O2 470.548000 |
VZRQXNCQAZNAPQ-SANMLTNESA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473454; PubChem:CID146456693
|
Local ready
Direct docking supported
|
|
E3L020079
BDB020079
|
US10844044, Example 340
N=C1CCCN1Cc1cc(C(=O)N[C@H](c2ccc(F)c(Cl)c2)C2CC2)cc(-c2cccnc2C(F)(F)F)c1
|
C28H25ClF4N4O 544.980000 |
YFXVXPBFEUAGCL-VWLOTQADSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473455; PubChem:CID146455730
|
Local ready
Direct docking supported
|
|
E3L020080
BDB020080
|
US10844044, Example 66
Cc1cc([C@@H](NC(=O)c2cc(Cn3ccn(C)c3=N)cc(-c3ncc(F)cc3C)c2)C2CC2)ccc1F
|
C29H29F2N5O 501.581000 |
CGDWGNCJPSMSRS-MHZLTWQESA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473456; PubChem:CID146457578
|
Local ready
Direct docking supported
|