| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L030661
BDB030661
|
BDBM617516
CN1CCN(c2ccc(-n3cc(C(=O)NCCCN4CCOCC4)nn3)cc2NC(=O)c2ccc(F)c(C(F)(F)F)c2)CC1
|
C29H34F4N8O3 618.636000 |
FOVWBSYLWCHKAC-UHFFFAOYSA-N | P61964, Q03164 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM617516; PubChem:CID168679379
|
Local ready
Direct docking supported
|
|
E3L030662
BDB030662
|
Amezalpat
CCOc1ccc(-c2cccc(CCCc3nn(Cc4ccc(C(C)(C)C)cc4)c(=O)n3CC)c2)cc1CC(=O)O
|
C34H41N3O4 555.719000 |
KUPVZYDOHAPPNF-UHFFFAOYSA-N | P37231, Q07869 | Peroxisome proliferator-activated receptor alpha, Peroxisome proliferator-activated receptor gamma |
BindingDB, PubChem
BindingDB:BDBM617517; PubChem:CID76285852
|
Local ready
Direct docking supported
|
|
E3L030663
BDB030663
|
BDBM617518
Cc1cc(C)cc(C(=O)Nc2cc(-n3cc(C(=O)NCCCN4CCOCC4)nn3)ccc2N2CCN(C)CC2)c1
|
C30H40N8O3 560.703000 |
VRMQMMDYSBYDCQ-UHFFFAOYSA-N | P61964, Q03164 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM617518; PubChem:CID168679380
|
Local ready
Direct docking supported
|
|
E3L030664
BDB030664
|
BDBM617519
CN1CCN(c2ccc(-n3cc(C(=O)NCCCN4CCOCC4)nn3)cc2NC(=O)c2cc(Cl)cc(Cl)c2)CC1
|
C28H34Cl2N8O3 601.539000 |
BIVNEGUQALNGBE-UHFFFAOYSA-N | P61964, Q03164 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM617519; PubChem:CID168679381
|
Local ready
Direct docking supported
|
|
E3L030665
BDB030665
|
BDBM617520
CN1CCN(c2ccc(-n3cc(C(=O)NCCCN4CCOCC4)nn3)cc2NC(=O)c2cc(O)cc(C(F)(F)F)c2)CC1
|
C29H35F3N8O4 616.645000 |
AGUJNFYYINFUHH-UHFFFAOYSA-N | P61964, Q03164 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM617520; PubChem:CID168679382
|
Local ready
Direct docking supported
|
|
E3L030666
BDB030666
|
BDBM617521
CN1CCN(c2ccc(-n3cc(C(=O)NCCCN4CCOCC4)nn3)cc2NC(=O)c2cc(O)cc(F)c2F)CC1
|
C28H34F2N8O4 584.628000 |
IFGDIJKPPDBEPZ-UHFFFAOYSA-N | P61964, Q03164 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM617521; PubChem:CID168679383
|
Local ready
Direct docking supported
|
|
E3L030667
BDB030667
|
BDBM617522
CN1CCN(c2ccc(-n3cc(C(=O)NCCCN4CCOCC4)nn3)cc2NC(=O)c2nn(C)c3ccccc23)CC1
|
C30H38N10O3 586.701000 |
ABQIWKYBRKUULQ-UHFFFAOYSA-N | P61964, Q03164 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM617522; PubChem:CID168679384
|
Local ready
Direct docking supported
|
|
E3L030668
BDB030668
|
BDBM617523
Cc1c(F)ccc(C(=O)Nc2cc(-n3cc(C(=O)NCCCN4CCOCC4)nn3)c(F)cc2N2CCN(C)CC2)c1Cl
|
C29H35ClF2N8O3 617.101000 |
ATUNNVWCKUKSQK-UHFFFAOYSA-N | P61964, Q03164 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM617523; PubChem:CID168679385
|
Local ready
Direct docking supported
|
|
E3L030669
BDB030669
|
BDBM617524
CCN(CC)C(=O)c1cn(-c2cc(NC(=O)c3cc(N)c(F)c(C)c3Cl)c(N3C[C@@H](C)N(C)[C@@H](C)C3)cc2F)nn1
|
C28H35ClF2N8O2 589.091000 |
ZXHKWXJHZNMEBY-IYBDPMFKSA-N | P61964, Q03164 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM617524; PubChem:CID168679386
|
Local ready
Direct docking supported
|
|
E3L030670
BDB030670
|
BDBM617525
Cc1c(F)c(N)cc(C(=O)Nc2cc(-n3cc(C(=O)N4CCOCC4)nn3)c(F)cc2N2C[C@@H](C)N(C)[C@@H](C)C2)c1Cl
|
C28H33ClF2N8O3 603.074000 |
VZBVNPMSSKIZIR-IYBDPMFKSA-N | P61964, Q03164 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM617525; PubChem:CID168679387
|
Local ready
Direct docking supported
|
|
E3L030671
BDB030671
|
formula IIIb [WO2023177592]
Cc1c(F)c(N)cc(C(=O)Nc2cc(-n3cc(C(=O)N4CCN(C)CC4)nn3)c(F)cc2N2C[C@@H](C)N(C)[C@@H](C)C2)c1Cl
|
C29H36ClF2N9O2 616.117000 |
ZAAAXOTWIKLEGP-CALCHBBNSA-N | P61964, Q03164 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM617526; PubChem:CID168679388
|
Local ready
Direct docking supported
|
|
E3L030672
BDB030672
|
BDBM617528
Cc1c(F)c(N)cc(C(=O)Nc2cc(-n3cc(C(=O)NC4CCCCC4)nn3)c(F)cc2N2C[C@@H](C)N(C)[C@@H](C)C2)c1Cl
|
C30H37ClF2N8O2 615.129000 |
JXQTVWSUMTYJKP-CALCHBBNSA-N | P61964, Q03164 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM617528; PubChem:CID168679389
|
Local ready
Direct docking supported
|
|
E3L030673
BDB030673
|
BDBM617529
Cc1c(F)c(N)cc(C(=O)Nc2cc(-n3cc(C(=O)NC4CCOCC4)nn3)c(F)cc2N2C[C@@H](C)N(C)[C@@H](C)C2)c1Cl
|
C29H35ClF2N8O3 617.101000 |
LPIDLPNUIRWPLW-IYBDPMFKSA-N | P61964, Q03164 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM617529; PubChem:CID168679390
|
Local ready
Direct docking supported
|
|
E3L030674
BDB030674
|
BDBM617530
Cc1c(F)c(N)cc(C(=O)Nc2cc(-n3cc(C(=O)NC4CCN(C)CC4)nn3)c(F)cc2N2C[C@@H](C)N(C)[C@@H](C)C2)c1Cl
|
C30H38ClF2N9O2 630.144000 |
JKYKRBWPDXKTNA-CALCHBBNSA-N | P61964, Q03164 | WD repeat-containing protein 5 |
BindingDB
BindingDB:BDBM617530
|
Local ready
Direct docking supported
|
|
E3L030675
BDB030675
|
BDBM617531
Cc1c(F)c(N)cc(C(=O)Nc2cc(-n3cc(C(=O)NCCCN4CCN(C)CC4)nn3)c(F)cc2N2C[C@@H](C)N(C)[C@@H](C)C2)c1Cl
|
C32H43ClF2N10O2 673.213000 |
RMWRJJKYEBHVKT-BGYRXZFFSA-N | P61964, Q03164 | WD repeat-containing protein 5 |
BindingDB
BindingDB:BDBM617531
|
Local ready
Direct docking supported
|
|
E3L030676
BDB030676
|
BDBM617532
Cc1c(F)c(N)cc(C(=O)Nc2cc(-n3cc(C(=O)NCC4CCCCC4)nn3)c(F)cc2N2C[C@@H](C)N(C)[C@@H](C)C2)c1Cl
|
C31H39ClF2N8O2 629.156000 |
OVFWZPRZFJQFTG-HDICACEKSA-N | P61964, Q03164 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM617532; PubChem:CID168679393
|
Local ready
Direct docking supported
|
|
E3L030677
BDB030677
|
BDBM617672
CN1CCN(c2ccc(-n3cc(C(=O)NCCCN4CCOCC4)nn3)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)CC1
|
C28H34F3N9O4 617.633000 |
GMSPHUWKTGKYAX-UHFFFAOYSA-N | P61964, Q03164 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM617672; PubChem:CID169052377
|
Local ready
Direct docking supported
|
|
E3L030678
BDB030678
|
BDBM617673
CN1CCN(c2ccc(-n3cc(C(=O)NCCCN4CCOCC4)nn3)cc2NC(=O)c2cnc(Cl)cc2C(F)(F)F)CC1
|
C28H33ClF3N9O3 636.079000 |
PMHZGZVEQXMNKB-UHFFFAOYSA-N | P61964, Q03164 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM617673; PubChem:CID168679403
|
Local ready
Direct docking supported
|
|
E3L030679
BDB030679
|
BDBM617674
C[C@H]1CN(c2ccc(-n3cc(C(=O)NCCCN4CCOCC4)nn3)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)CCN1C
|
C29H36F3N9O4 631.660000 |
FSXXWYTYGCHOGK-IBGZPJMESA-N | P61964, Q03164 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM617674; PubChem:CID169052300
|
Local ready
Direct docking supported
|
|
E3L030680
BDB030680
|
BDBM617675
CN1CCN(c2cc(F)c(-n3cc(C(=O)NCCCN4CCOCC4)nn3)cc2NC(=O)c2c[nH]c(=O)cc2C(F)(F)F)CC1
|
C28H33F4N9O4 635.623000 |
HZZUZGYPEWWYLD-UHFFFAOYSA-N | P61964, Q03164 | WD repeat-containing protein 5 |
BindingDB, PubChem
BindingDB:BDBM617675; PubChem:CID169052470
|
Local ready
Direct docking supported
|