| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L050141
BDB050141
|
BDBM50259477
CCOC(=O)c1cccc(-c2cnc3ccc(N[C@@H](CC)CO)nn23)c1
|
C19H22N4O3 354.410000 |
DSCUTYQYWCTFQL-HNNXBMFYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50259477; PubChem:CID137638509
|
Local ready
Direct docking supported
|
|
E3L050142
BDB050142
|
BDBM50259517
CC[C@@H](CO)Nc1ccc2ncc(-c3cccc(C(=O)O)c3)n2n1
|
C17H18N4O3 326.356000 |
WCXPUTJZKXHALD-ZDUSSCGKSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50259517; PubChem:CID137652970
|
Local ready
Direct docking supported
|
|
E3L050143
BDB050143
|
BDBM50259518
COc1ccc2ncc(-c3ccnc(N)n3)n2n1
|
C11H10N6O 242.242000 |
XLUOKXQFFGFGNB-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50259518; PubChem:CID137651668
|
Local ready
Direct docking supported
|
|
E3L050144
BDB050144
|
BDBM50259519
Nc1ccc(Cl)cc1-c1cnc2ccc(Cl)nn12
|
C12H8Cl2N4 279.130000 |
XDTSBZLQROEIPM-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50259519; PubChem:CID137643887
|
Local ready
Direct docking supported
|
|
E3L050145
BDB050145
|
BDBM50259520
CC[C@H](CO)NC(=O)c1cccc(-c2cnc3ccc(Cl)nn23)c1
|
C17H17ClN4O2 344.802000 |
DPVHKRYDZPCZCT-CYBMUJFWSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50259520; PubChem:CID137650421
|
Local ready
Direct docking supported
|
|
E3L050146
BDB050146
|
BDBM50259521
CC[C@@H](CO)Nc1ccc2ncc(-c3cc4cc(Br)ccc4[nH]3)n2n1
|
C18H18BrN5O 400.280000 |
QQCCFMCJVKPTMI-ZDUSSCGKSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50259521; PubChem:CID137646497
|
Local ready
Direct docking supported
|
|
E3L050147
BDB050147
|
BDBM50259523
CC[C@@H](CO)Nc1ccc2ncc(-c3ccc(C(F)(F)F)cc3)n2n1
|
C17H17F3N4O 350.344000 |
IZURDRXMCYDUFB-ZDUSSCGKSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50259523; PubChem:CID137658150
|
Local ready
Direct docking supported
|
|
E3L050148
BDB050148
|
BDBM50259524
CC[C@@H](CO)Nc1ccc2ncc(-c3cc(Cl)ccc3N)n2n1
|
C16H18ClN5O 331.807000 |
DKGZXXQSVKWPRW-NSHDSACASA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50259524; PubChem:CID137633419
|
Local ready
Direct docking supported
|
|
E3L050149
BDB050149
|
BDBM50259525
CC[C@@H](CO)Nc1ccc2ncc(-c3ccnc(S(C)(=O)=O)n3)n2n1
|
C15H18N6O3S 362.415000 |
RWVARJSWZIIHSJ-JTQLQIEISA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50259525; PubChem:CID137635713
|
Local ready
Direct docking supported
|
|
E3L050150
BDB050150
|
BDBM50259526
CC[C@@H](CO)Nc1ccc2ncc(-c3cccc(C=O)c3)n2n1
|
C17H18N4O2 310.357000 |
OHARPIGKJAKOCM-AWEZNQCLSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50259526; PubChem:CID137655848
|
Local ready
Direct docking supported
|
|
E3L050151
BDB050151
|
BDBM50259527
CC[C@@H](CO)/N=C/c1cccc(-c2cnc3ccc(N[C@@H](CC)CO)nn23)c1
|
C21H27N5O2 381.480000 |
SZOYOCHRMSEEMG-AIHKSIKWSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50259527
|
Local ready
Direct docking supported
|
|
E3L050152
BDB050152
|
BDBM50259543
CC[C@@H](CO)NC(=O)c1cccc(-c2cnc3ccc(N[C@@H](CC)CO)nn23)c1
|
C21H27N5O3 397.479000 |
KCXBBJNHGRCSQQ-IRXDYDNUSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50259543; PubChem:CID137638944
|
Local ready
Direct docking supported
|
|
E3L050153
BDB050153
|
BDBM50259553
CC(C)[C@@H](CO)Nc1ccc2ncc(-c3cccnc3)n2n1
|
C16H19N5O 297.362000 |
VBYRFFCBZNEHAL-CYBMUJFWSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50259553; PubChem:CID137640811
|
Local ready
Direct docking supported
|
|
E3L050154
BDB050154
|
BDBM50259556
CCOC(=O)Nc1ccc2ncc(-c3cccnc3)n2n1
|
C14H13N5O2 283.291000 |
CEIVAPWZRJLAEW-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50259556; PubChem:CID137647969
|
Local ready
Direct docking supported
|
|
E3L050155
BDB050155
|
BDBM50259558
CCOC(=O)Nc1ccc2ncc(-c3cccc(Cl)c3)n2n1
|
C15H13ClN4O2 316.748000 |
DZYTUBQFYNVYGA-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50259558; PubChem:CID137652047
|
Local ready
Direct docking supported
|
|
E3L050156
BDB050156
|
BDBM50259559
OCCN1CCN(c2ccc3ncc(-c4cccc(Cl)c4)n3n2)CC1
|
C18H20ClN5O 357.845000 |
GVANUSPDJMCBIK-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50259559; PubChem:CID137639514
|
Local ready
Direct docking supported
|
|
E3L050157
BDB050157
|
BDBM50259560
Clc1cccc(-c2cnc3ccc(N4CCC(N5CCCCC5)CC4)nn23)c1
|
C22H26ClN5 395.938000 |
CEHSVNYYAPNMFI-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50259560; PubChem:CID137635556
|
Local ready
Direct docking supported
|
|
E3L050158
BDB050158
|
BDBM50259561
CC[C@@H](CO)N(C(C)=O)c1ccc2ncc(-c3cccc(NC(C)=O)c3)n2n1
|
C20H23N5O3 381.436000 |
YELPLVUUDHOICI-KRWDZBQOSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50259561; PubChem:CID137653000
|
Local ready
Direct docking supported
|
|
E3L050159
BDB050159
|
BDBM50259562
COc1ccc2ncc(/C=C/c3cccc(C(F)(F)F)c3)n2n1
|
C16H12F3N3O 319.286000 |
JNNGGJDFTJICDZ-AATRIKPKSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50259562; PubChem:CID137644974
|
Local ready
Direct docking supported
|
|
E3L050160
BDB050160
|
BDBM50259569
CC(=O)Nc1cccc(Nc2ccc3ncc(-c4cccc(Cl)c4)n3n2)c1
|
C20H16ClN5O 377.835000 |
AINKQRBPBUTJRM-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50259569; PubChem:CID137640934
|
Local ready
Direct docking supported
|