| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L016001
BDB016001
|
BDBM347957
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCC4CCC4)n3)c2)cn1
|
C23H25N7 399.502000 |
VYMWIVHKLJFCMV-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347957; PubChem:CID121357857
|
Local ready
Direct docking supported
|
|
E3L016002
BDB016002
|
BDBM347958
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NC[C@H]4CC[C@@H](O)C4)n3)c2)cn1
|
C24H27N7O 429.528000 |
ARZAFZSJLDFLAJ-HRAATJIYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347958; PubChem:CID121357862
|
Local ready
Direct docking supported
|
|
E3L016003
BDB016003
|
BDBM347959
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NC[C@H]4CC[C@H](O)C4)n3)c2)cn1
|
C24H27N7O 429.528000 |
ARZAFZSJLDFLAJ-KKSFZXQISA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347959; PubChem:CID121357859
|
Local ready
Direct docking supported
|
|
E3L016004
BDB016004
|
BDBM347960
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCC4CCOC4)n3)c2)cn1
|
C23H25N7O 415.501000 |
OLXFEWAMNHOWMU-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347960; PubChem:CID121357861
|
Local ready
Direct docking supported
|
|
E3L016005
BDB016005
|
BDBM347961
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NC4CCC(O)C4)n3)c2)cn1
|
C23H25N7O 415.501000 |
PAZMLZLHHPILSR-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347961; PubChem:CID121357863
|
Local ready
Direct docking supported
|
|
E3L016006
BDB016006
|
BDBM347962
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NC4CCC5CN(S(C)(=O)=O)CC54)n3)c2)cn1
|
C26H30N8O2S 518.647000 |
KWIJLQOBOWRJPV-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347962; PubChem:CID121357864
|
Local ready
Direct docking supported
|
|
E3L016007
BDB016007
|
BDBM347963
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NC4CC5(CCN(S(C)(=O)=O)C5)C4)n3)c2)cn1
|
C26H30N8O2S 518.647000 |
IPZCKIRKUDTKAH-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347963; PubChem:CID121357865
|
Local ready
Direct docking supported
|
|
E3L016008
BDB016008
|
BDBM347964
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(N[C@H]4CCN(S(C)(=O)=O)C4)n3)c2)cn1
|
C23H26N8O2S 478.582000 |
FZDJXVAWYBYVTH-FQEVSTJZSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347964; PubChem:CID121357866
|
Local ready
Direct docking supported
|
|
E3L016009
BDB016009
|
BDBM347965
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(N[C@@H]4CCN(S(C)(=O)=O)C4)n3)c2)cn1
|
C23H26N8O2S 478.582000 |
FZDJXVAWYBYVTH-HXUWFJFHSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347965; PubChem:CID121357867
|
Local ready
Direct docking supported
|
|
E3L016010
BDB016010
|
BDBM347966
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCC4CN(S(C)(=O)=O)CCO4)n3)c2)cn1
|
C24H28N8O3S 508.608000 |
QGUWKGBZVOGRGA-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347966; PubChem:CID121357868
|
Local ready
Direct docking supported
|
|
E3L016011
BDB016011
|
BDBM347967
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCC4[C@H]5CN(S(C)(=O)=O)C[C@@H]45)n3)c2)cn1
|
C25H28N8O2S 504.620000 |
AQQXBVGVZRVHBA-NOTZXAQLSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347967; PubChem:CID121357869
|
Local ready
Direct docking supported
|
|
E3L016012
BDB016012
|
BDBM347968
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NC[C@H]4CCN(S(C)(=O)=O)C4)n3)c2)cn1
|
C24H28N8O2S 492.609000 |
ZWKRJPFIGSCCFS-QGZVFWFLSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347968; PubChem:CID121357870
|
Local ready
Direct docking supported
|
|
E3L016013
BDB016013
|
BDBM347969
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCCC4CCN(S(C)(=O)=O)C4)n3)c2)cn1
|
C25H30N8O2S 506.636000 |
ZVVNQPGCNBMROC-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347969; PubChem:CID121357873
|
Local ready
Direct docking supported
|
|
E3L016014
BDB016014
|
BDBM347970
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(N[C@@H]4CC[C@H](NS(C)(=O)=O)C4)n3)c2)cn1
|
C24H28N8O2S 492.609000 |
NDEMKIYZHBESJY-RTWAWAEBSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347970; PubChem:CID121357871
|
Local ready
Direct docking supported
|
|
E3L016015
BDB016015
|
BDBM347971
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCCCCNS(C)(=O)=O)n3)c2)cn1
|
C23H28N8O2S 480.598000 |
ORTJDUOECINQJS-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347971; PubChem:CID121357967
|
Local ready
Direct docking supported
|
|
E3L016016
BDB016016
|
BDBM347972
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NC4CCCCN(S(C)(=O)=O)C4)n3)c2)cn1
|
C25H30N8O2S 506.636000 |
KDEVAODGQITDKB-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347972; PubChem:CID121357872
|
Local ready
Direct docking supported
|
|
E3L016017
BDB016017
|
BDBM347973
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCCCNS(C)(=O)=O)n3)c2)cn1
|
C22H26N8O2S 466.571000 |
CXCVVVVOGXOQOQ-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347973; PubChem:CID121357876
|
Local ready
Direct docking supported
|
|
E3L016018
BDB016018
|
BDBM347974
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NC4CC(CO)(CO)C4)n3)c2)cn1
|
C24H27N7O2 445.527000 |
TWFRHKNZDSAPOT-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347974; PubChem:CID121357874
|
Local ready
Direct docking supported
|
|
E3L016019
BDB016019
|
BDBM347975
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCC4CC(O)C4)n3)c2)cn1
|
C23H25N7O 415.501000 |
DVCQNDLDUIPIPD-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347975; PubChem:CID121357875
|
Local ready
Direct docking supported
|
|
E3L016020
BDB016020
|
BDBM347976
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(N[C@H]4CC[C@H](NS(C)(=O)=O)CC4)n3)c2)cn1
|
C25H30N8O2S 506.636000 |
XSLLIHGJXBVYOG-HZCBDIJESA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB
BindingDB:BDBM347976
|
Local ready
Direct docking supported
|