| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L015961
BDB015961
|
BDBM347917
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCC4CCCC(O)C4)n3)c2)cn1
|
C25H29N7O 443.555000 |
MKBKKMSPJMRACX-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347917; PubChem:CID121357823
|
Local ready
Direct docking supported
|
|
E3L015962
BDB015962
|
BDBM347918
Cn1cc(-c2cccc(-c3ncc(-c4ccn(C)n4)c(N[C@H]4C[C@@H](N)C4)n3)c2)cn1
|
C22H24N8 400.490000 |
FPPAEZQMHMCZAB-HDICACEKSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB
BindingDB:BDBM347918
|
Local ready
Direct docking supported
|
|
E3L015963
BDB015963
|
BDBM347919
Cn1cc(-c2cccc(-c3ncc(-c4ccn(C)n4)c(NC4CCCCNC4)n3)c2)cn1
|
C24H28N8 428.544000 |
VJORIFWGPCUKQE-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347919; PubChem:CID121357825
|
Local ready
Direct docking supported
|
|
E3L015964
BDB015964
|
BDBM347920
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NC[C@H]4CCNC[C@H]4O)n3)c2)cn1
|
C24H28N8O 444.543000 |
RCWDLUNSANAZGF-XMSQKQJNSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347920; PubChem:CID121357829
|
Local ready
Direct docking supported
|
|
E3L015965
BDB015965
|
BDBM347921
Cc1nnc(-c2cnc(-c3cccc(-c4cnn(C)c4)c3)nc2NCCN2CCS(=O)(=O)CC2)s1
|
C23H26N8O2S2 510.649000 |
QCELRETUHNQFIM-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347921; PubChem:CID121357828
|
Local ready
Direct docking supported
|
|
E3L015966
BDB015966
|
BDBM347922
Cc1nnc(-c2cnc(-c3cccc(-c4cnn(C)c4)c3)nc2NC2CCC(N)CC2)s1
|
C23H26N8S 446.584000 |
QGRQFIXWJXBWPI-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347922; PubChem:CID121357830
|
Local ready
Direct docking supported
|
|
E3L015967
BDB015967
|
BDBM347923
Cc1nnc(-c2cnc(-c3cccc(-c4cnn(C)c4)c3)nc2N[C@H]2CC[C@@H](NS(C)(=O)=O)CC2)s1
|
C24H28N8O2S2 524.676000 |
UTIGOFYWZOYJCR-BGYRXZFFSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB
BindingDB:BDBM347923
|
Local ready
Direct docking supported
|
|
E3L015968
BDB015968
|
BDBM347924
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(N[C@@H]4CNC[C@@H](F)C4)n3)c2)cn1
|
C23H25FN8 432.507000 |
FDZPILGOIAJRAI-PMACEKPBSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347924; PubChem:CID121357831
|
Local ready
Direct docking supported
|
|
E3L015969
BDB015969
|
BDBM347925
Cn1cc(-c2cccc(-c3ncc(-c4ccn(C)n4)c(N[C@@H]4CCC[C@@H](O)[C@H]4O)n3)c2)cn1
|
C24H27N7O2 445.527000 |
VTHZNBKOPFWHOL-VSKRKVRLSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347925; PubChem:CID121357832
|
Local ready
Direct docking supported
|
|
E3L015970
BDB015970
|
BDBM347926
Cn1cc(-c2cccc(-c3ncc(-c4ccn(C)n4)c(O[C@@H]4CCC[C@@H](N)[C@@H]4O)n3)c2)cn1
|
C24H27N7O2 445.527000 |
TUQMDKJRSRLFMP-FCEUIQTBSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347926; PubChem:CID121357833
|
Local ready
Direct docking supported
|
|
E3L015971
BDB015971
|
BDBM347927
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(N[C@@H]4CCC[C@@H](O)[C@H]4O)n3)c2)cn1
|
C24H27N7O2 445.527000 |
UVHWQKYXRJARRI-VSKRKVRLSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347927; PubChem:CID121347834
|
Local ready
Direct docking supported
|
|
E3L015972
BDB015972
|
BDBM347928
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(O[C@@H]4CCC[C@@H](N)[C@@H]4O)n3)c2)cn1
|
C24H27N7O2 445.527000 |
KVOIBFBXADXYTG-VSKRKVRLSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347928; PubChem:CID121347824
|
Local ready
Direct docking supported
|
|
E3L015973
BDB015973
|
BDBM347929
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCCC(C)(C)O)n3)c2)cn1
|
C23H27N7O 417.517000 |
AEXMNSSSGGQEQL-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347929; PubChem:CID121357836
|
Local ready
Direct docking supported
|
|
E3L015974
BDB015974
|
BDBM347930
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCC4CCC(F)(F)CC4)n3)c2)cn1
|
C25H27F2N7 463.536000 |
AAVYPFWLIYEXPD-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347930; PubChem:CID121357834
|
Local ready
Direct docking supported
|
|
E3L015975
BDB015975
|
BDBM347931
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NC4CCOCC4)n3)c2)cn1
|
C23H25N7O 415.501000 |
WXDQRKZVJRQFCU-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347931; PubChem:CID121357835
|
Local ready
Direct docking supported
|
|
E3L015976
BDB015976
|
BDBM347932
Cn1cc(-c2cccc(-c3ncc(-c4ccn(C)n4)c(NC4CCOCC4)n3)c2)cn1
|
C23H25N7O 415.501000 |
AETWKAOLZXOERG-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347932; PubChem:CID121357837
|
Local ready
Direct docking supported
|
|
E3L015977
BDB015977
|
BDBM347933
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCCCC(C)(C)O)n3)c2)cn1
|
C24H29N7O 431.544000 |
FYPLNZXUWFDWFV-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347933; PubChem:CID121357838
|
Local ready
Direct docking supported
|
|
E3L015978
BDB015978
|
BDBM347934
Cn1cc(-c2cccc(-c3ncc(-c4ccn(C)n4)c(NCCCC(C)(C)O)n3)c2)cn1
|
C24H29N7O 431.544000 |
GCYKZGYYQMTSQA-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347934; PubChem:CID121357839
|
Local ready
Direct docking supported
|
|
E3L015979
BDB015979
|
BDBM347935
CN(CC1CC(F)(F)C1)c1nc(-c2cccc(-c3cnn(C)c3)c2)ncc1-c1cnn(C)c1
|
C24H25F2N7 449.509000 |
SYBALGURGFDLRV-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347935; PubChem:CID121357840
|
Local ready
Direct docking supported
|
|
E3L015980
BDB015980
|
BDBM347936
CN(CC1CC(F)(F)C1)c1nc(-c2cccc(-c3cnn(C)c3)c2)ncc1-c1ccn(C)n1
|
C24H25F2N7 449.509000 |
PEZAOZDZXLEDPV-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347936; PubChem:CID121357841
|
Local ready
Direct docking supported
|