| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L015881
BDB015881
|
BDBM347837
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCC4(C)CCC4)n3)c2)cn1
|
C24H27N7 413.529000 |
JZUXTONNGLAGNS-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347837; PubChem:CID121357750
|
Local ready
Direct docking supported
|
|
E3L015882
BDB015882
|
BDBM347838
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(N[C@H]4CC[C@@H](N)CC4)n3)c2)cn1
|
C24H28N8 428.544000 |
HRKWQXXRXVOSOT-OYRHEFFESA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB
BindingDB:BDBM347838
|
Local ready
Direct docking supported
|
|
E3L015883
BDB015883
|
BDBM347839
CN(CC1(F)COC1)c1nc(-c2cccc(-c3cnn(C)c3)c2)ncc1-c1cnn(C)c1
|
C23H24FN7O 433.491000 |
CVUYMCPYMRJEPD-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347839; PubChem:CID121357751
|
Local ready
Direct docking supported
|
|
E3L015884
BDB015884
|
BDBM347840
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(N[C@H]4C[C@@H](O)C4)n3)c2)cn1
|
C22H23N7O 401.474000 |
RWRVISCWYIIYAX-KDURUIRLSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB
BindingDB:BDBM347840
|
Local ready
Direct docking supported
|
|
E3L015885
BDB015885
|
BDBM347841
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(N[C@H]4C[C@H](O)C4)n3)c2)cn1
|
C22H23N7O 401.474000 |
RWRVISCWYIIYAX-WGSAOQKQSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB
BindingDB:BDBM347841
|
Local ready
Direct docking supported
|
|
E3L015886
BDB015886
|
BDBM347842
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NC4CC(F)(F)C4)n3)c2)cn1
|
C22H21F2N7 421.455000 |
WUGZCFHBTBZAKK-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347842; PubChem:CID121357755
|
Local ready
Direct docking supported
|
|
E3L015887
BDB015887
|
BDBM347843
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(N[C@H]4C[C@@H](S(C)(=O)=O)C4)n3)c2)cn1
|
C23H25N7O2S 463.567000 |
ZRJZIWDFCSJDNF-BGYRXZFFSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB
BindingDB:BDBM347843
|
Local ready
Direct docking supported
|
|
E3L015888
BDB015888
|
BDBM347844
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NC4CC(F)C4)n3)c2)cn1
|
C22H22FN7 403.465000 |
LKLKMYFYHDFSLS-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347844; PubChem:CID121357758
|
Local ready
Direct docking supported
|
|
E3L015889
BDB015889
|
BDBM347845
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCCCN4CCOCC4)n3)c2)cn1
|
C25H30N8O 458.570000 |
LDKDQUHHADIBMB-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347845; PubChem:CID121357756
|
Local ready
Direct docking supported
|
|
E3L015890
BDB015890
|
BDBM347846
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCC4(O)COC4)n3)c2)cn1
|
C22H23N7O2 417.473000 |
CJAZGMFJTFNQTF-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347846; PubChem:CID121357754
|
Local ready
Direct docking supported
|
|
E3L015891
BDB015891
|
BDBM347847
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCC4(CO)CCC4)n3)c2)cn1
|
C24H27N7O 429.528000 |
KCKPZBIPGDQIND-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347847; PubChem:CID121357759
|
Local ready
Direct docking supported
|
|
E3L015892
BDB015892
|
BDBM347848
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NC[C@H](O)CO)n3)c2)cn1
|
C21H23N7O2 405.462000 |
WWNTVVYKRQBYEQ-SFHVURJKSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347848; PubChem:CID121357760
|
Local ready
Direct docking supported
|
|
E3L015893
BDB015893
|
BDBM347849
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCCN4CCS(=O)(=O)CC4)n3)c2)cn1
|
C24H28N8O2S 492.609000 |
AAZZPIVKPGOXMK-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347849; PubChem:CID121357761
|
Local ready
Direct docking supported
|
|
E3L015894
BDB015894
|
BDBM347850
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NC[C@@H](O)CO)n3)c2)cn1
|
C21H23N7O2 405.462000 |
WWNTVVYKRQBYEQ-GOSISDBHSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347850; PubChem:CID121357763
|
Local ready
Direct docking supported
|
|
E3L015895
BDB015895
|
BDBM347851
CC(=O)NCCNc1nc(-c2cccc(-c3cnn(C)c3)c2)ncc1-c1cnn(C)c1
|
C22H24N8O 416.489000 |
JXSBVAFKVRLTBE-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347851; PubChem:CID121360885
|
Local ready
Direct docking supported
|
|
E3L015896
BDB015896
|
BDBM347852
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCCN4CCNC4=O)n3)c2)cn1
|
C23H25N9O 443.515000 |
XIFSQCAJQIQDIP-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347852; PubChem:CID121357959
|
Local ready
Direct docking supported
|
|
E3L015897
BDB015897
|
BDBM347853
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCC4CNCCO4)n3)c2)cn1
|
C23H26N8O 430.516000 |
BITLDNRLVOIKSQ-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347853; PubChem:CID121357762
|
Local ready
Direct docking supported
|
|
E3L015898
BDB015898
|
BDBM347854
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(N[C@H]4CCC(=O)NC4)n3)c2)cn1
|
C23H24N8O 428.500000 |
PIJSHCDNEZVWMX-IBGZPJMESA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347854; PubChem:CID121357764
|
Local ready
Direct docking supported
|
|
E3L015899
BDB015899
|
BDBM347855
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NC[C@@H]4CCC(=O)N4)n3)c2)cn1
|
C23H24N8O 428.500000 |
UYRUQSJFNMNBEN-IBGZPJMESA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347855; PubChem:CID121357765
|
Local ready
Direct docking supported
|
|
E3L015900
BDB015900
|
BDBM347856
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(N[C@H]4C[C@@H](N)C4)n3)c2)cn1
|
C22H24N8 400.490000 |
NRQLGEWVVODBQU-KDURUIRLSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB
BindingDB:BDBM347856
|
Local ready
Direct docking supported
|