| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L063841
BDB063841
|
BDBM50627386
Cn1ncc2cc(/C=C3\N=C(NC4CCCCCC4)NC3=O)ccc21
|
C19H23N5O 337.427000 |
PPQSZAVBAJMLRF-WJDWOHSUSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627386; PubChem:CID168147295
|
Local ready
Direct docking supported
|
|
E3L063842
BDB063842
|
BDBM50627387
Cn1cc2cc(/C=C3\N=C(NC4CCCCCC4)NC3=O)ccc2n1
|
C19H23N5O 337.427000 |
OTHYGYNOCOBONC-BOPFTXTBSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627387; PubChem:CID168147365
|
Local ready
Direct docking supported
|
|
E3L063843
BDB063843
|
BDBM50627388
O=C1NC(NC2CCCCCC2)=N/C1=C\c1ccc2[nH]ccc2c1
|
C19H22N4O 322.412000 |
KYJFWJBSBHKSNV-ATVHPVEESA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50627388
|
Local ready
Direct docking supported
|
|
E3L063844
BDB063844
|
BDBM50627389
Cn1ccc2cc(/C=C3\N=C(NC4CCCCCC4)NC3=O)ccc21
|
C20H24N4O 336.439000 |
XHAWUNBEFXSQDK-LGMDPLHJSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627389; PubChem:CID172466067
|
Local ready
Direct docking supported
|
|
E3L063845
BDB063845
|
BDBM50627390
O=C1NC(NC23CC4CC(CC(C4)C2)C3)=N/C1=C\c1ccc2c(c1)OCO2
|
C21H23N3O3 365.433000 |
KBMQGIPVJGXLOU-SOFYXZRVSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627390; PubChem:CID172457362
|
Local ready
Direct docking supported
|
|
E3L063846
BDB063846
|
BDBM50627391
O=C1NC(NC23CC4CC(CC(C4)C2)C3)=N/C1=C\c1ccc2nnsc2c1
|
C20H21N5OS 379.489000 |
WWRVEMKSOIGGCS-SOFYXZRVSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627391; PubChem:CID168239456
|
Local ready
Direct docking supported
|
|
E3L063847
BDB063847
|
BDBM50627392
Cc1nc2ccc(/C=C3\N=C(NC45CC6CC(CC(C6)C4)C5)NC3=O)cc2s1
|
C22H24N4OS 392.528000 |
ZBKFRVXDYILXFJ-WSVATBPTSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627392; PubChem:CID166523507
|
Local ready
Direct docking supported
|
|
E3L063848
BDB063848
|
BDBM50627393
O=C1NC(NC23CC4CC(CC(C4)C2)C3)=N/C1=C\c1ccc2scnc2c1
|
C21H22N4OS 378.501000 |
HCBGQLCXZWXYLW-IDUWFGFVSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627393; PubChem:CID156484027
|
Local ready
Direct docking supported
|
|
E3L063849
BDB063849
|
BDBM50627394
O=C1NC(NC23CC4CC(CC(C4)C2)C3)=N/C1=C\c1ccc2ncoc2c1
|
C21H22N4O2 362.433000 |
BUDHVVXPBGMAPV-FMQZQXMHSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627394; PubChem:CID168147541
|
Local ready
Direct docking supported
|
|
E3L063850
BDB063850
|
BDBM50627395
O=C1NC(NC23CC4CC(CC(C4)C2)C3)=N/C1=C\c1ccc2c(c1)CCO2
|
C22H25N3O2 363.461000 |
UMYSGMXAOXMMGG-NVMNQCDNSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627395; PubChem:CID172440849
|
Local ready
Direct docking supported
|
|
E3L063851
BDB063851
|
BDBM50627396
O=C1NC(NC23CC4CC(CC(C4)C2)C3)=N/C1=C\c1ccc2[nH]cnc2c1
|
C21H23N5O 361.449000 |
YEZMGVBTPDYRPO-WSVATBPTSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50627396
|
Local ready
Direct docking supported
|
|
E3L063852
BDB063852
|
BDBM50627397
Cn1cnc2ccc(/C=C3\N=C(NC45CC6CC(CC(C6)C4)C5)NC3=O)cc21
|
C22H25N5O 375.476000 |
SLKHMZQUNIHINK-WSVATBPTSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627397; PubChem:CID168147471
|
Local ready
Direct docking supported
|
|
E3L063853
BDB063853
|
BDBM50627398
Cn1cnc2cc(/C=C3\N=C(NC45CC6CC(CC(C6)C4)C5)NC3=O)ccc21
|
C22H25N5O 375.476000 |
WKXYVRVPZHUFLW-LSCVHKIXSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627398; PubChem:CID172457638
|
Local ready
Direct docking supported
|
|
E3L063854
BDB063854
|
BDBM50627399
O=C1NC(NC23CC4CC(CC(C4)C2)C3)=N/C1=C\c1ccc2[nH]ncc2c1
|
C21H23N5O 361.449000 |
YJKPCYDSZXIODK-WSVATBPTSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50627399
|
Local ready
Direct docking supported
|
|
E3L063855
BDB063855
|
BDBM50627400
Cn1ncc2cc(/C=C3\N=C(NC45CC6CC(CC(C6)C4)C5)NC3=O)ccc21
|
C22H25N5O 375.476000 |
FANUXQYVRUHAAH-LSCVHKIXSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627400; PubChem:CID168147466
|
Local ready
Direct docking supported
|
|
E3L063856
BDB063856
|
BDBM50627401
Cn1cc2cc(/C=C3\N=C(NC45CC6CC(CC(C6)C4)C5)NC3=O)ccc2n1
|
C22H25N5O 375.476000 |
CIICGXXZCWRFQE-UWVJOHFNSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627401; PubChem:CID168147319
|
Local ready
Direct docking supported
|
|
E3L063857
BDB063857
|
BDBM50627402
O=C1NC(NC23CC4CC(CC(C4)C2)C3)=N/C1=C\c1ccc2[nH]ccc2c1
|
C22H24N4O 360.461000 |
UGSYHPNOTPGEAF-OCKHKDLRSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50627402
|
Local ready
Direct docking supported
|
|
E3L063858
BDB063858
|
BDBM50627403
Cn1ccc2cc(/C=C3\N=C(NC45CC6CC(CC(C6)C4)C5)NC3=O)ccc21
|
C23H26N4O 374.488000 |
NFTDGASFBRRENP-GRSHGNNSSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627403; PubChem:CID172442411
|
Local ready
Direct docking supported
|
|
E3L063859
BDB063859
|
BDBM50627404
O=C1NC(NC2CC2)=N/C1=C\c1ccc2ncsc2c1
|
C14H12N4OS 284.344000 |
CSNGPDJYNPSXNA-WZUFQYTHSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627404; PubChem:CID162346655
|
Local ready
Direct docking supported
|
|
E3L063860
BDB063860
|
BDBM50627405
O=C1NC(NC2CCC2)=N/C1=C\c1ccc2ncsc2c1
|
C15H14N4OS 298.371000 |
AQLWSCZCZJWUMZ-SDQBBNPISA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627405; PubChem:CID162346690
|
Local ready
Direct docking supported
|