| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L063821
BDB063821
|
BDBM50627366
O=C1NC(NC2CCCCC2)=N/C1=C\c1ccc2ncoc2c1
|
C17H18N4O2 310.357000 |
VQAZMVUNBILJGW-ZSOIEALJSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627366; PubChem:CID168147273
|
Local ready
Direct docking supported
|
|
E3L063822
BDB063822
|
BDBM50627367
O=C1NC(NC2CCCCC2)=N/C1=C\c1ccc2c(c1)CCO2
|
C18H21N3O2 311.385000 |
DVZORWAPBGBTCT-PTNGSMBKSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627367; PubChem:CID172460371
|
Local ready
Direct docking supported
|
|
E3L063823
BDB063823
|
BDBM50627368
O=C1NC(NC2CCCCC2)=N/C1=C\c1ccc2[nH]cnc2c1
|
C17H19N5O 309.373000 |
RWUAJNWQCLQAAA-DHDCSXOGSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50627368
|
Local ready
Direct docking supported
|
|
E3L063824
BDB063824
|
BDBM50627369
Cn1cnc2ccc(/C=C3\N=C(NC4CCCCC4)NC3=O)cc21
|
C18H21N5O 323.400000 |
GCUNCFYJKLSBKK-DHDCSXOGSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627369; PubChem:CID168147403
|
Local ready
Direct docking supported
|
|
E3L063825
BDB063825
|
BDBM50627370
Cn1cnc2cc(/C=C3\N=C(NC4CCCCC4)NC3=O)ccc21
|
C18H21N5O 323.400000 |
PKBNTMLJKDPPHG-GDNBJRDFSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627370; PubChem:CID172448951
|
Local ready
Direct docking supported
|
|
E3L063826
BDB063826
|
BDBM50627371
O=C1NC(NC2CCCCC2)=N/C1=C\c1ccc2[nH]ncc2c1
|
C17H19N5O 309.373000 |
ZJVGZWWTWGRGFK-DHDCSXOGSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50627371
|
Local ready
Direct docking supported
|
|
E3L063827
BDB063827
|
BDBM50627372
Cn1ncc2cc(/C=C3\N=C(NC4CCCCC4)NC3=O)ccc21
|
C18H21N5O 323.400000 |
HFZLFYUNSURMIG-GDNBJRDFSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627372; PubChem:CID168147500
|
Local ready
Direct docking supported
|
|
E3L063828
BDB063828
|
BDBM50627373
Cn1cc2cc(/C=C3\N=C(NC4CCCCC4)NC3=O)ccc2n1
|
C18H21N5O 323.400000 |
FJICMLZOGOVQRG-YBEGLDIGSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627373; PubChem:CID168147223
|
Local ready
Direct docking supported
|
|
E3L063829
BDB063829
|
BDBM50627374
O=C1NC(NC2CCCCC2)=N/C1=C\c1ccc2[nH]ccc2c1
|
C18H20N4O 308.385000 |
YDOQCMXWZVEJMN-WJDWOHSUSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50627374
|
Local ready
Direct docking supported
|
|
E3L063830
BDB063830
|
BDBM50627375
Cn1ccc2cc(/C=C3\N=C(NC4CCCCC4)NC3=O)ccc21
|
C19H22N4O 322.412000 |
LMQPBSVYHVLSBA-VBKFSLOCSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627375; PubChem:CID172470801
|
Local ready
Direct docking supported
|
|
E3L063831
BDB063831
|
BDBM50627376
O=C1NC(NC2CCCCCC2)=N/C1=C\c1ccc2c(c1)OCO2
|
C18H21N3O3 327.384000 |
ZUADZDBGZDSSAB-ZROIWOOFSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627376; PubChem:CID172449235
|
Local ready
Direct docking supported
|
|
E3L063832
BDB063832
|
BDBM50627377
O=C1NC(NC2CCCCCC2)=N/C1=C\c1ccc2nnsc2c1
|
C17H19N5OS 341.440000 |
QFWQVHZBLABPSP-ZROIWOOFSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627377; PubChem:CID168239470
|
Local ready
Direct docking supported
|
|
E3L063833
BDB063833
|
BDBM50627378
Cc1nc2ccc(/C=C3\N=C(NC4CCCCCC4)NC3=O)cc2s1
|
C19H22N4OS 354.479000 |
CVDZJUNTQGTGHF-YBEGLDIGSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627378; PubChem:CID166523472
|
Local ready
Direct docking supported
|
|
E3L063834
BDB063834
|
BDBM50627379
O=C1NC(NC2CCCCCC2)=N/C1=C\c1ccc2scnc2c1
|
C18H20N4OS 340.452000 |
CXRDTOPRYXCMRJ-GDNBJRDFSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627379; PubChem:CID172454020
|
Local ready
Direct docking supported
|
|
E3L063835
BDB063835
|
BDBM50627380
O=C1NC(NC2CCCCCC2)=N/C1=C\c1ccc2ncoc2c1
|
C18H20N4O2 324.384000 |
RAQBQAXSLHDSKW-DHDCSXOGSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627380; PubChem:CID168147346
|
Local ready
Direct docking supported
|
|
E3L063836
BDB063836
|
BDBM50627381
O=C1NC(NC2CCCCCC2)=N/C1=C\c1ccc2c(c1)CCO2
|
C19H23N3O2 325.412000 |
VOMDKRFMVUYOOQ-VBKFSLOCSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627381; PubChem:CID172460680
|
Local ready
Direct docking supported
|
|
E3L063837
BDB063837
|
BDBM50627382
O=C1NC(NC2CCCCCC2)=N/C1=C\c1ccc2[nH]cnc2c1
|
C18H21N5O 323.400000 |
XXIXFZAUCITSCM-YBEGLDIGSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50627382
|
Local ready
Direct docking supported
|
|
E3L063838
BDB063838
|
BDBM50627383
Cn1cnc2ccc(/C=C3\N=C(NC4CCCCCC4)NC3=O)cc21
|
C19H23N5O 337.427000 |
HBBPDNLIBIZZFL-YBEGLDIGSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627383; PubChem:CID168147242
|
Local ready
Direct docking supported
|
|
E3L063839
BDB063839
|
BDBM50627384
Cn1cnc2cc(/C=C3\N=C(NC4CCCCCC4)NC3=O)ccc21
|
C19H23N5O 337.427000 |
QMTWBCDTINIGKH-WJDWOHSUSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB, PubChem
BindingDB:BDBM50627384; PubChem:CID172448108
|
Local ready
Direct docking supported
|
|
E3L063840
BDB063840
|
BDBM50627385
O=C1NC(NC2CCCCCC2)=N/C1=C\c1ccc2[nH]ncc2c1
|
C18H21N5O 323.400000 |
COYCDCAUDJBGOV-YBEGLDIGSA-N | Q92630 | Dual specificity tyrosine-phosphorylation-regulated kinase 2 |
BindingDB
BindingDB:BDBM50627385
|
Local ready
Direct docking supported
|