| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L015941
BDB015941
|
BDBM347897
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NC4CCC(=O)NC4)n3)c2)cn1
|
C23H24N8O 428.500000 |
PIJSHCDNEZVWMX-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347897; PubChem:CID121357803
|
Local ready
Direct docking supported
|
|
E3L015942
BDB015942
|
BDBM347898
Cn1cc(-c2cccc(-c3ncc(-c4ccn(C)n4)c(NC[C@H]4CCNC4)n3)c2)cn1
|
C23H26N8 414.517000 |
BORFUWYMIJRVOF-INIZCTEOSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347898; PubChem:CID121357806
|
Local ready
Direct docking supported
|
|
E3L015943
BDB015943
|
BDBM347899
CN1CCOC(CNc2nc(-c3cccc(-c4cnn(C)c4)c3)ncc2-c2cnn(C)c2)C1
|
C24H28N8O 444.543000 |
OVSBUHZVZDQGES-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347899; PubChem:CID121357805
|
Local ready
Direct docking supported
|
|
E3L015944
BDB015944
|
BDBM347900
Cn1cc(-c2cccc(-c3ncc(-c4nnc(C(=O)N5CC[C@@H](O)C5)s4)c(NCC4CNC4)n3)c2)cn1
|
C25H27N9O2S 517.619000 |
VTUODBRBWHKXAG-LJQANCHMSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347900; PubChem:CID121357804
|
Local ready
Direct docking supported
|
|
E3L015945
BDB015945
|
BDBM347901
Cn1cc(-c2cccc(-c3ncc(-c4ccn(C)n4)c(N[C@@H]4CC[C@H](N)C4)n3)c2)cn1
|
C23H26N8 414.517000 |
RPMCQWGLLTVGAY-RBUKOAKNSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347901; PubChem:CID121357808
|
Local ready
Direct docking supported
|
|
E3L015946
BDB015946
|
BDBM347902
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(N[C@@H]4CC[C@H](N)C4)n3)c2)cn1
|
C23H26N8 414.517000 |
UABWFXULANPTAV-VQTJNVASSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347902; PubChem:CID121357809
|
Local ready
Direct docking supported
|
|
E3L015947
BDB015947
|
BDBM347903
CC(=O)NCCCNc1nc(-c2cccc(-c3cnn(C)c3)c2)ncc1-c1cnn(C)c1
|
C23H26N8O 430.516000 |
NBOIOHHVHAPORR-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347903; PubChem:CID121357810
|
Local ready
Direct docking supported
|
|
E3L015948
BDB015948
|
BDBM347904
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCCN4CCC(O)CC4)n3)c2)cn1
|
C25H30N8O 458.570000 |
SVAIUGXLBAPZEZ-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347904; PubChem:CID121357811
|
Local ready
Direct docking supported
|
|
E3L015949
BDB015949
|
BDBM347905
Cn1cc(-c2cccc(-c3ncc(-c4ccn(C)n4)c(N[C@H]4CC[C@@H](N)CC4)n3)c2)cn1
|
C24H28N8 428.544000 |
SQKCJZMLLYDNDV-BGYRXZFFSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB
BindingDB:BDBM347905
|
Local ready
Direct docking supported
|
|
E3L015950
BDB015950
|
BDBM347906
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(NCC4(O)CCNCC4(C)C)n3)c2)cn1
|
C26H32N8O 472.597000 |
GZXRQRCTEBICGP-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347906; PubChem:CID121357813
|
Local ready
Direct docking supported
|
|
E3L015951
BDB015951
|
BDBM347907
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(N[C@@H]4CNC[C@H]4O)n3)c2)cn1
|
C22H24N8O 416.489000 |
GDGGJEQTJDVTTG-WOJBJXKFSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347907; PubChem:CID121357815
|
Local ready
Direct docking supported
|
|
E3L015952
BDB015952
|
BDBM347908
Cn1cc(-c2cccc(-c3ncc(-c4ccn(C)n4)c(NCC4(O)CCNCC4(C)C)n3)c2)cn1
|
C26H32N8O 472.597000 |
OODSWQOLNQOOEK-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347908; PubChem:CID121357814
|
Local ready
Direct docking supported
|
|
E3L015953
BDB015953
|
BDBM347909
Cn1cc(-c2cccc(-c3ncc(-c4ccn(C)n4)c(NCC4CNCCO4)n3)c2)cn1
|
C23H26N8O 430.516000 |
GEFOLSFVVAUQDX-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347909; PubChem:CID121357816
|
Local ready
Direct docking supported
|
|
E3L015954
BDB015954
|
BDBM347910
Cn1cc(-c2cccc(-c3ncc(-c4ccn(C)n4)c(NC[C@H]4CCNC[C@H]4O)n3)c2)cn1
|
C24H28N8O 444.543000 |
JCJYOVXKIJNIKS-XMSQKQJNSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347910; PubChem:CID121357817
|
Local ready
Direct docking supported
|
|
E3L015955
BDB015955
|
BDBM347911
Cn1cc(-c2cccc(-c3ncc(-c4ccn(C)n4)c(N[C@H]4CCNC4)n3)c2)cn1
|
C22H24N8 400.490000 |
OKKIGWQBZKTXLY-SFHVURJKSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347911; PubChem:CID121357818
|
Local ready
Direct docking supported
|
|
E3L015956
BDB015956
|
BDBM347912
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(OCC4CCCO4)n3)c2)cn1
|
C23H24N6O2 416.485000 |
NIPIREKHNAUZIB-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347912; PubChem:CID121357819
|
Local ready
Direct docking supported
|
|
E3L015957
BDB015957
|
BDBM347913
Cn1cc(-c2cccc(-c3ncc(-c4ccn(C)n4)c(NC4CCOC4)n3)c2)cn1
|
C22H23N7O 401.474000 |
MRHACWXWDJTBGE-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347913; PubChem:CID121357820
|
Local ready
Direct docking supported
|
|
E3L015958
BDB015958
|
BDBM347914
Cn1cc(-c2cccc(-c3ncc(-c4ccn(C)n4)c(NC[C@H](O)CO)n3)c2)cn1
|
C21H23N7O2 405.462000 |
ZXICHULZXNAPKS-KRWDZBQOSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347914; PubChem:CID121357821
|
Local ready
Direct docking supported
|
|
E3L015959
BDB015959
|
BDBM347915
Cn1cc(-c2cccc(-c3ncc(-c4cnn(C)c4)c(N[C@H]4CCNC4)n3)c2)cn1
|
C22H24N8 400.490000 |
CKBWZUMWUOJBRS-IBGZPJMESA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347915; PubChem:CID121357827
|
Local ready
Direct docking supported
|
|
E3L015960
BDB015960
|
BDBM347916
Cn1cc(-c2cccc(-c3ncc(-c4ccn(C)n4)c(NCC4CCCC(O)C4)n3)c2)cn1
|
C25H29N7O 443.555000 |
WQCGBCNFUIVHCV-UHFFFAOYSA-N | P51617 | Interleukin-1 receptor-associated kinase 1 |
BindingDB, PubChem
BindingDB:BDBM347916; PubChem:CID121357824
|
Local ready
Direct docking supported
|