| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L053421
BDB053421
|
BDBM50347746
O=C1NC(Nc2ccc(O)cc2)=NC1=Cc1ccc2c(c1)OCO2
|
C17H13N3O4 323.308000 |
VRGNMDTYOWQXQC-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50347746; PubChem:CID137158690
|
Local ready
Direct docking supported
|
|
E3L053422
BDB053422
|
BDBM50347747
COc1ccc(NC2=NC(=Cc3ccc4c(c3)OCO4)C(=O)N2)cc1
|
C18H15N3O4 337.335000 |
UGUVGLVHRPLWRS-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50347747
|
Local ready
Direct docking supported
|
|
E3L053423
BDB053423
|
BDBM50347748
O=C1NC(Nc2ccc3c(c2)OCO3)=NC1=Cc1ccc2c(c1)OCO2
|
C18H13N3O5 351.318000 |
QKACFWBQLNCAPU-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50347748; PubChem:CID137156451
|
Local ready
Direct docking supported
|
|
E3L053424
BDB053424
|
BDBM50347749
O=C1NC(Nc2ccc3c(c2)OCCO3)=NC1=Cc1ccc2c(c1)OCO2
|
C19H15N3O5 365.345000 |
DZVXEFRGRDZOSG-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50347749
|
Local ready
Direct docking supported
|
|
E3L053425
BDB053425
|
BDBM50347750
O=C1NC(Nc2ccccc2)=NC1=Cc1ccc2c(c1)OCO2
|
C17H13N3O3 307.309000 |
PGPHHJBZEGSUNE-UHFFFAOYSA-N | P51617, Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2, Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM50347750; PubChem:CID137118627
|
Local ready
Direct docking supported
|
|
E3L053426
BDB053426
|
BDBM50347751
CCCNC1=NC(=Cc2cc(OC)c(OC)c(OC)c2)C(=O)N1C
|
C17H23N3O4 333.388000 |
LOZCTJFVVWWJQE-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50347751
|
Local ready
Direct docking supported
|
|
E3L053427
BDB053427
|
BDBM50347754
CNC1=NC(=Cc2ccc3c(c2)OCO3)C(=O)N1C
|
C13H13N3O3 259.265000 |
CJNRNWLLZDWPDT-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50347754
|
Local ready
Direct docking supported
|
|
E3L053428
BDB053428
|
BDBM50347755
CCNC1=NC(=Cc2ccc3c(c2)OCO3)C(=O)N1C
|
C14H15N3O3 273.292000 |
OQZNCAIFCVGTSZ-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50347755
|
Local ready
Direct docking supported
|
|
E3L053429
BDB053429
|
BDBM50347756
CCCNC1=NC(=Cc2ccc3c(c2)OCO3)C(=O)N1C
|
C15H17N3O3 287.319000 |
SGWXBOBKZVIVOW-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50347756; PubChem:CID136628274
|
Local ready
Direct docking supported
|
|
E3L053430
BDB053430
|
BDBM50347757
CC(C)NC1=NC(=Cc2ccc3c(c2)OCO3)C(=O)N1C
|
C15H17N3O3 287.319000 |
ILLXEUXWCCUOCH-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50347757
|
Local ready
Direct docking supported
|
|
E3L053431
BDB053431
|
BDBM50347758
CCCCNC1=NC(=Cc2ccc3c(c2)OCO3)C(=O)N1C
|
C16H19N3O3 301.346000 |
FSOXXUBGNVMVGH-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50347758
|
Local ready
Direct docking supported
|
|
E3L053432
BDB053432
|
BDBM50347759
CN1C(=O)C(=Cc2ccc3c(c2)OCO3)N=C1Nc1ccc(O)cc1
|
C18H15N3O4 337.335000 |
MMWGSUYGZVUNCC-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50347759
|
Local ready
Direct docking supported
|
|
E3L053433
BDB053433
|
BDBM50347760
COc1ccc(NC2=NC(=Cc3ccc4c(c3)OCO4)C(=O)N2C)cc1
|
C19H17N3O4 351.362000 |
OZGASTZOHHWYOH-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50347760
|
Local ready
Direct docking supported
|
|
E3L053434
BDB053434
|
BDBM50347761
CN1C(=O)C(=Cc2ccc3c(c2)OCO3)N=C1Nc1ccc2c(c1)OCO2
|
C19H15N3O5 365.345000 |
BSRSIUKJQSEGFR-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50347761
|
Local ready
Direct docking supported
|
|
E3L053435
BDB053435
|
BDBM50347762
CN1C(=O)C(=Cc2ccc3c(c2)OCO3)N=C1Nc1ccc2c(c1)OCCO2
|
C20H17N3O5 379.372000 |
AMAGLSOYOINTBJ-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50347762
|
Local ready
Direct docking supported
|
|
E3L053436
BDB053436
|
BDBM50347763
CC(C)CNC1=NC(=Cc2ccc3c(c2)OCO3)C(=O)N1C
|
C16H19N3O3 301.346000 |
JLSDXZDLSSIKNL-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50347763
|
Local ready
Direct docking supported
|
|
E3L053437
BDB053437
|
BDBM50347764
CC(C)CCNC1=NC(=Cc2ccc3c(c2)OCO3)C(=O)N1C
|
C17H21N3O3 315.373000 |
DQUFBQPETORSKP-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50347764
|
Local ready
Direct docking supported
|
|
E3L053438
BDB053438
|
BDBM50347765
C=CCNC1=NC(=Cc2ccc3c(c2)OCO3)C(=O)N1C
|
C15H15N3O3 285.303000 |
ZXBILXRDKWZLIW-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50347765
|
Local ready
Direct docking supported
|
|
E3L053439
BDB053439
|
BDBM50347766
CN1C(=O)C(=Cc2ccc3c(c2)OCO3)N=C1NCC1CC1
|
C16H17N3O3 299.330000 |
OBKVROGZKBOQSW-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50347766
|
Local ready
Direct docking supported
|
|
E3L053440
BDB053440
|
BDBM50347767
CN1C(=O)C(=Cc2ccc3c(c2)OCO3)N=C1NC1CCCC1
|
C17H19N3O3 313.357000 |
QCVHGXFDDAVZBK-UHFFFAOYSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50347767
|
Local ready
Direct docking supported
|