| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L049281
BDB049281
|
BDBM50236018
Cc1ccsc1CNc1c(C#N)cc(-c2ccc(CN(C)C)cc2)c2nncn12
|
C22H22N6S 402.527000 |
BVYSRBICAFJOOB-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM50236018; PubChem:CID137648968
|
Local ready
Direct docking supported
|
|
E3L049282
BDB049282
|
BDBM50236019
COc1ccccc1CNc1c(C#N)cc(-c2ccc(CN(C)C)cc2)c2nncn12
|
C24H24N6O 412.497000 |
NHCJRDUPKRKLEC-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM50236019; PubChem:CID137660778
|
Local ready
Direct docking supported
|
|
E3L049283
BDB049283
|
BDBM50236020
Cc1ccc(CNc2c(C#N)cc(-c3ccc(CN(C)C)cc3)c3nncn23)s1
|
C22H22N6S 402.527000 |
MVXMVVXFUZEBBV-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM50236020; PubChem:CID137642235
|
Local ready
Direct docking supported
|
|
E3L049284
BDB049284
|
BDBM50236021
CN(C)Cc1ccc(-c2cc(C#N)c(NCc3sccc3Cl)n3cnnc23)cc1
|
C21H19ClN6S 422.945000 |
UUYKTQMOXKPELI-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM50236021; PubChem:CID137637638
|
Local ready
Direct docking supported
|
|
E3L049285
BDB049285
|
BDBM50236022
Cc1ccc(CNc2ncc(-c3ccc(CN(C)C)cc3)c3nncn23)s1
|
C20H22N6S 378.505000 |
ORRVEKJGHPHCRM-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM50236022; PubChem:CID137659190
|
Local ready
Direct docking supported
|
|
E3L049286
BDB049286
|
BDBM50236023
CN(C)Cc1ccc(-c2cnc(NCc3sccc3Cl)n3cnnc23)cc1
|
C19H19ClN6S 398.923000 |
JLMUQCDDWZVOBA-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM50236023; PubChem:CID137648098
|
Local ready
Direct docking supported
|
|
E3L049287
BDB049287
|
BDBM50236024
COc1ccccc1CNc1ncc(-c2ccc(CN(C)C)cc2)c2nncn12
|
C22H24N6O 388.475000 |
RRJHFRSYECVXSF-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM50236024; PubChem:CID137646810
|
Local ready
Direct docking supported
|
|
E3L049288
BDB049288
|
BDBM50236362
COc1cc2nccc(Oc3ccc4c(C(=O)Nc5ccc(Cl)cc5)cccc4c3)c2cc1OC
|
C28H21ClN2O4 484.939000 |
WUBFAXNVDMCVIO-UHFFFAOYSA-N | O14965 | Aurora kinase A |
BindingDB, PubChem
BindingDB:BDBM50236362; PubChem:CID24757938
|
Local ready
Direct docking supported
|
|
E3L049289
BDB049289
|
BDBM50236536
Oc1ccc(-c2cnc3[nH]cc(-c4ccc(-c5nnn[nH]5)cc4)c3c2)cc1
|
C20H14N6O 354.373000 |
QZIYOWZOZNSBGJ-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50236536; PubChem:CID137657691
|
Local ready
Direct docking supported
|
|
E3L049290
BDB049290
|
BDBM50236537
Oc1ccc(-c2cnc3[nH]cc(-c4ccc5[nH]ccc5c4)c3c2)cc1
|
C21H15N3O 325.371000 |
UDBMFFIMVBBFKP-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50236537; PubChem:CID137647526
|
Local ready
Direct docking supported
|
|
E3L049291
BDB049291
|
4-[3-(4-hydroxyphenyl)-1H-indazol-5-yl]phenol
Oc1ccc(-c2ccc3[nH]nc(-c4ccc(O)cc4)c3c2)cc1
|
C19H14N2O2 302.333000 |
HJSBIVFFPRFFDM-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50236538; PubChem:CID137646758
|
Local ready
Direct docking supported
|
|
E3L049292
BDB049292
|
4-[3-(4-hydroxyphenyl)-1H-indol-5-yl]phenol
Oc1ccc(-c2ccc3[nH]cc(-c4ccc(O)cc4)c3c2)cc1
|
C20H15NO2 301.345000 |
OYTWHNGVDJBJBY-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50236539; PubChem:CID73426232
|
Local ready
Direct docking supported
|
|
E3L049293
BDB049293
|
BDBM50236540
O=C(Nc1ccc(O)cc1)c1cnc2[nH]cc(-c3ccc(O)cc3)c2c1
|
C20H15N3O3 345.358000 |
BUDHBLBYISRDCR-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50236540; PubChem:CID137648784
|
Local ready
Direct docking supported
|
|
E3L049294
BDB049294
|
BDBM50236541
NC(=O)Nc1ccc(-c2cnc3[nH]cc(-c4ccc(O)cc4)c3c2)cc1
|
C20H16N4O2 344.374000 |
JJUHKRNDDMOYGK-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50236541; PubChem:CID137633814
|
Local ready
Direct docking supported
|
|
E3L049295
BDB049295
|
BDBM50236542
CS(=O)(=O)Nc1ccc(-c2cnc3[nH]cc(-c4ccc(O)cc4)c3c2)cc1
|
C20H17N3O3S 379.441000 |
KOMXYYABYRRJBD-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50236542; PubChem:CID137643957
|
Local ready
Direct docking supported
|
|
E3L049296
BDB049296
|
BDBM50236543
CC(=O)Nc1ccc(-c2cnc3[nH]cc(-c4ccc(O)cc4)c3c2)cc1
|
C21H17N3O2 343.386000 |
PVFNDFZQGWYILU-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50236543; PubChem:CID137649821
|
Local ready
Direct docking supported
|
|
E3L049297
BDB049297
|
BDBM50236544
Nc1ccc(-c2cnc3[nH]cc(-c4ccc(O)cc4)c3c2)cc1
|
C19H15N3O 301.349000 |
ATXGVVQAUKKFAN-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50236544; PubChem:CID137654129
|
Local ready
Direct docking supported
|
|
E3L049298
BDB049298
|
BDBM50236545
Oc1ccc(-c2c[nH]c3ncc(-c4ccc(-c5nnn[nH]5)cc4)cc23)cc1
|
C20H14N6O 354.373000 |
XVVPNHZWUXCHJE-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50236545; PubChem:CID137641785
|
Local ready
Direct docking supported
|
|
E3L049299
BDB049299
|
BDBM50236546
Oc1ccc(-c2c[nH]c3ncc(-c4ccc5[nH]ccc5c4)cc23)cc1
|
C21H15N3O 325.371000 |
GPMRASYSIQENIJ-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50236546; PubChem:CID137632412
|
Local ready
Direct docking supported
|
|
E3L049300
BDB049300
|
BDBM50236547
O=[N+]([O-])c1ccc(-c2cnc3[nH]cc(-c4ccc(O)cc4)c3c2)cc1
|
C19H13N3O3 331.331000 |
WKDIVCXCWMVLPY-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50236547; PubChem:CID137649037
|
Local ready
Direct docking supported
|