| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L063921
BDB063921
|
BDBM50627466
CCOC[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1
|
C19H24N4O2S 372.494000 |
BDMXFIMYKGLQAL-MEFZMRIGSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627466; PubChem:CID166523521
|
Local ready
Direct docking supported
|
|
E3L063922
BDB063922
|
BDBM50627467
CC(C)C[C@H](COC1CC1)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1
|
C20H24N4O2S 384.505000 |
IVSYLIPATGYBCZ-XPGOGFAUSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627467; PubChem:CID166523471
|
Local ready
Direct docking supported
|
|
E3L063923
BDB063923
|
BDBM50627468
CC(C)C[C@H](COC(C)(C)C)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1
|
C21H28N4O2S 400.548000 |
FRPUHWUHZZNNOB-GESOSKEOSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627468; PubChem:CID166523492
|
Local ready
Direct docking supported
|
|
E3L063924
BDB063924
|
BDBM50627469
CC(C)C[C@H](COCc1ccccc1)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1
|
C24H26N4O2S 434.565000 |
DSQFWMPIQBMOJL-WVGJEZMVSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627469; PubChem:CID166523516
|
Local ready
Direct docking supported
|
|
E3L063925
BDB063925
|
BDBM50627470
CC(C)C[C@H](COCc1ccc(F)cc1)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1
|
C24H25FN4O2S 452.555000 |
LASLZTNNTZVYMJ-ZRRZKUONSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627470; PubChem:CID166523502
|
Local ready
Direct docking supported
|
|
E3L063926
BDB063926
|
BDBM50627471
COCC(NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)C1CCCCC1
|
C20H24N4O2S 384.505000 |
BUDGLAJKNWCXIM-SXGWCWSVSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627471; PubChem:CID162346750
|
Local ready
Direct docking supported
|
|
E3L063927
BDB063927
|
BDBM50627472
COC(CNC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)C1CCCCC1
|
C20H24N4O2S 384.505000 |
NSDQDNNJFIKBKR-SXGWCWSVSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627472; PubChem:CID162346647
|
Local ready
Direct docking supported
|
|
E3L063928
BDB063928
|
BDBM50627473
COC(=O)[C@H](C)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1
|
C15H14N4O3S 330.369000 |
UMWJBFSPIYCGRG-SDZLHINSSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627473; PubChem:CID162346667
|
Local ready
Direct docking supported
|
|
E3L063929
BDB063929
|
BDBM50627474
COC(=O)[C@@H](NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)C(C)C
|
C17H18N4O3S 358.423000 |
DCHAEDURAZJASA-ZDWRTJATSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627474; PubChem:CID162346748
|
Local ready
Direct docking supported
|
|
E3L063930
BDB063930
|
BDBM50627475
COC(=O)[C@@H](NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)C(C)O
|
C16H16N4O4S 360.395000 |
USYASDQVUTWEQM-ITZJNCSMSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627475; PubChem:CID162346740
|
Local ready
Direct docking supported
|
|
E3L063931
BDB063931
|
BDBM50627476
COC(=O)[C@@H](CC(C)C)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1
|
C18H20N4O3S 372.450000 |
OEVQTWCGWDOIFZ-SVSAJMPUSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627476; PubChem:CID162346721
|
Local ready
Direct docking supported
|
|
E3L063932
BDB063932
|
BDBM50627477
COC(=O)[C@H](CC(C)C)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1
|
C18H20N4O3S 372.450000 |
OEVQTWCGWDOIFZ-LVOZBFFPSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627477; PubChem:CID162346641
|
Local ready
Direct docking supported
|
|
E3L063933
BDB063933
|
BDBM50627478
CC(C)C[C@H](CF)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1
|
C17H19FN4OS 346.431000 |
FIVWKNZKXNNFCW-KXQKXUNCSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627478; PubChem:CID166523526
|
Local ready
Direct docking supported
|
|
E3L063934
BDB063934
|
BDBM50627479
CC(C)C[C@@H](CF)NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1
|
C17H19FN4OS 346.431000 |
FIVWKNZKXNNFCW-JVXNRYDGSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627479; PubChem:CID166523475
|
Local ready
Direct docking supported
|
|
E3L063935
BDB063935
|
BDBM50627480
O=C1NC(NCC23CC4CC(CC(C4)C2)C3)=N/C1=C\c1ccc2ncsc2c1
|
C22H24N4OS 392.528000 |
MXEZQEFCKXVMFN-FXBPXSCXSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627480; PubChem:CID162346692
|
Local ready
Direct docking supported
|
|
E3L063936
BDB063936
|
BDBM50627481
CC(NC1=N/C(=C\c2ccc3ncsc3c2)C(=O)N1)C12CC3CC(CC(C3)C1)C2
|
C23H26N4OS 406.555000 |
OWCUQTMFJUAAHV-GXHLCREISA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627481; PubChem:CID162346680
|
Local ready
Direct docking supported
|
|
E3L063937
BDB063937
|
BDBM50627482
O=C1NC(NC2C3CC4CC(C3)CC2C4)=N/C1=C\c1ccc2ncsc2c1
|
C21H22N4OS 378.501000 |
GEJSQZULGDKBQV-IUXPMGMMSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627482; PubChem:CID162346698
|
Local ready
Direct docking supported
|
|
E3L063938
BDB063938
|
BDBM50627483
O=C1NC(N[C@H]2C3CC4CC2C[C@](O)(C4)C3)=N/C1=C\c1ccc2ncsc2c1
|
C21H22N4O2S 394.500000 |
JFDRONLMXPRQPP-MEODAHEFSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50627483
|
Local ready
Direct docking supported
|
|
E3L063939
BDB063939
|
BDBM50627484
COC(=O)C1(NC2=N/C(=C\c3ccc4ncsc4c3)C(=O)N2)C2CC3CC(C2)CC1C3
|
C23H24N4O3S 436.537000 |
YGVLUDLFNRZMNT-NVMNQCDNSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627484; PubChem:CID166523483
|
Local ready
Direct docking supported
|
|
E3L063940
BDB063940
|
BDBM50627485
O=C1NC(NC23CC4CC(CC2C4)C3)=N/C1=C\c1ccc2ncsc2c1
|
C20H20N4OS 364.474000 |
KHVQTEBOVFILCQ-SOFYXZRVSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627485; PubChem:CID168776270
|
Local ready
Direct docking supported
|