| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L020041
BDB020041
|
US10844044, Example 147
Cc1cc(CNC(=O)c2cc(Cn3ccn(C)c3=N)cc(OC(F)(F)F)c2)ccc1Cl
|
C21H20ClF3N4O2 452.864000 |
HZXNVVCPWNIAED-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473416; PubChem:CID146456101
|
Local ready
Direct docking supported
|
|
E3L020042
BDB020042
|
US10844044, Example 238
COc1cc(CNC(=O)c2cc(Cn3ccoc3=N)cc(-c3ncc(F)cc3C)c2)cc(OC)c1
|
C26H25FN4O4 476.508000 |
BQTKKMQHOOUHRL-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473417; PubChem:CID146455888
|
Local ready
Direct docking supported
|
|
E3L020043
BDB020043
|
US10844044, Example 331
Cc1nc(F)ccc1-c1cc(CN2CCCC2=N)cc(C(=O)NCc2ccc(Cl)c(Cl)c2)c1
|
C25H23Cl2FN4O 485.390000 |
BZOGQEZICWJLJG-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473419; PubChem:CID146456303
|
Local ready
Direct docking supported
|
|
E3L020044
BDB020044
|
US10844044, Example 57
Cc1cc(F)ccc1-c1cc(Cn2ccn(C)c2=N)cc(C(=O)Nc2nc3ccccc3s2)c1
|
C26H22FN5OS 471.561000 |
GVZUNXSGVIXLTP-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473420; PubChem:CID146457906
|
Local ready
Direct docking supported
|
|
E3L020045
BDB020045
|
US10844044, Example 148
Cn1ccn(Cc2cc(C(=O)N[C@@H](CC(=O)O)c3cccc(C(F)(F)F)c3)c(F)c(-c3ccc(F)cc3C(F)(F)F)c2)c1=N
|
C29H22F8N4O3 626.504000 |
GZSDPPWFWPRISX-QHCPKHFHSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473421; PubChem:CID146455929
|
Local ready
Direct docking supported
|
|
E3L020046
BDB020046
|
US10844044, Example 239
Cc1ccnc(C(NC(=O)c2cc(Cn3ccoc3=N)cc(-c3ncc(F)cc3C)c2)C2CC2)c1
|
C27H26FN5O2 471.536000 |
UYMWVRRXZMTIQC-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473422; PubChem:CID146457645
|
Local ready
Direct docking supported
|
|
E3L020047
BDB020047
|
US10844044, Example 332
Cc1cc(-c2cc(CN3CCCC3=N)cc(C(=O)NCc3ccc(Cl)c(Cl)c3)c2)c(C)cc1F
|
C27H26Cl2FN3O 498.429000 |
MZGTVDSJTZRYAM-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473423; PubChem:CID146455891
|
Local ready
Direct docking supported
|
|
E3L020048
BDB020048
|
US10844044, Example 58
Cc1cc(F)ccc1-c1cc(Cn2ccn(C)c2=N)cc(C(=O)N[C@H](C)c2ccc(Cl)c(Cl)c2)n1
|
C26H24Cl2FN5O 512.416000 |
BWYOIODDAPEQOB-MRXNPFEDSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473424; PubChem:CID146456258
|
Local ready
Direct docking supported
|
|
E3L020049
BDB020049
|
US10844044, Example 149
Cc1ccnc([C@@H](NC(=O)c2cc(Cn3ccn(C)c3=N)cc(OC(F)(F)F)c2)C2CC2)c1
|
C23H24F3N5O2 459.472000 |
GLTBQXGLLMFNRI-FQEVSTJZSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473425; PubChem:CID146456039
|
Local ready
Direct docking supported
|
|
E3L020050
BDB020050
|
US10844044, Example 240
Cc1cc([C@@H](NC(=O)c2cc(Cn3ccoc3=N)cc(-c3ncc(F)cc3C)c2)C2CC2)ccc1F
|
C28H26F2N4O2 488.538000 |
HDLNUTIGFBFGFB-SANMLTNESA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473426; PubChem:CID146455758
|
Local ready
Direct docking supported
|
|
E3L020051
BDB020051
|
US10844044, Example 333
Cc1cc([C@@H](NC(=O)c2cc(CN3CCCC3=N)cc(-c3ccc(F)cc3C#N)c2)C2CC2)ccc1F
|
C30H28F2N4O 498.577000 |
REZJSVQUKQTLGY-LJAQVGFWSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473427; PubChem:CID146457758
|
Local ready
Direct docking supported
|
|
E3L020052
BDB020052
|
US10844044, Example 59
Cc1cc(CNC(=O)c2cc(Cn3ccn(C)c3=N)cc(-c3c(C)cc(F)cc3C)c2)ccc1Cl
|
C28H28ClFN4O 491.010000 |
ZVARUBKVNDTQCA-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473428; PubChem:CID146457641
|
Local ready
Direct docking supported
|
|
E3L020053
BDB020053
|
US10844044, Example 150
Cn1ccn(Cc2cc(C(=O)N[C@H](c3ccc(Cl)c(Cl)c3)C3CC3)cc(-c3ccc(F)cc3OC(F)F)c2)c1=N
|
C29H25Cl2F3N4O2 589.445000 |
ILEAUHIFGBSRKK-SANMLTNESA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473429; PubChem:CID146456241
|
Local ready
Direct docking supported
|
|
E3L020054
BDB020054
|
US10844044, Example 241
Cc1cc([C@@H](NC(=O)c2cc(Cn3ccoc3=N)cc(-c3ncc(F)cc3C(F)(F)F)c2)C2CC2)ccc1F
|
C28H23F5N4O2 542.508000 |
OYLPPMAEYXOWRU-DEOSSOPVSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473430; PubChem:CID146455723
|
Local ready
Direct docking supported
|
|
E3L020055
BDB020055
|
US10844044, Example 334
Cc1cc([C@@H](NC(=O)c2cc(CN3CCCC3=N)cc(-c3cccnc3C(F)(F)F)c2)C2CC2)ccc1F
|
C29H28F4N4O 524.562000 |
UXMPAEDRDCLWDA-SANMLTNESA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473431; PubChem:CID146456213
|
Local ready
Direct docking supported
|
|
E3L020056
BDB020056
|
US10844044, Example 60
Cc1cc([C@@H](NC(=O)c2cc(Cn3ccn(C)c3=N)cc(-c3cccnc3C(F)(F)F)c2)C2CC2)ccc1F
|
C29H27F4N5O 537.561000 |
SGNRQWMFJWIFSN-VWLOTQADSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473432; PubChem:CID146456640
|
Local ready
Direct docking supported
|
|
E3L020057
BDB020057
|
US10844044, Example 151
N=c1n(Cc2cc(C(=O)N[C@H](c3ccc(Cl)c(Cl)c3)C3CC3)cc(-c3ccc(F)cc3OC(F)F)c2)ccn1C1CC1
|
C31H27Cl2F3N4O2 615.483000 |
CWMNWRNMZSVIAE-NDEPHWFRSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473433; PubChem:CID146456626
|
Local ready
Direct docking supported
|
|
E3L020058
BDB020058
|
US10844044, Example 242
Cc1cc([C@@H](NC(=O)c2cc(Cn3ccoc3=N)cc(-c3ccc(F)cc3OC(F)F)c2)C2CC2)ccc1F
|
C29H25F4N3O3 539.529000 |
UJSYVEZBFLFOKK-SANMLTNESA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473434; PubChem:CID146456018
|
Local ready
Direct docking supported
|
|
E3L020059
BDB020059
|
US10844044, Example 335
Cc1cc([C@@H](NC(=O)c2cc(CN3CCCC3=N)cc(-c3ccc(F)cc3C(F)(F)F)c2)C2CC2)ccc1F
|
C30H28F5N3O 541.564000 |
NZCKPPNHSKBSRH-NDEPHWFRSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473435; PubChem:CID146455900
|
Local ready
Direct docking supported
|
|
E3L020060
BDB020060
|
US10844044, Example 61
COc1cc(OC)cc(C(NC(=O)c2cc(Cn3ccn(C)c3=N)cc(-c3ncccc3C(F)(F)F)c2)C2CC2)c1
|
C30H30F3N5O3 565.596000 |
VUYWIXWYXGOUCX-UHFFFAOYSA-N | P61964 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM473436; PubChem:CID146455899
|
Local ready
Direct docking supported
|