Found 340 hits with Last Name = 'potter' and Initial = 'aj' Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647518
(US20240025893, Example b-04-44)Show SMILES C[C@H]1CN(CCN1[C@H]1C[C@H](C1)C(=O)Nc1nc2ccc(cc2s1)-c1cnc(CO[C@H]2CCC[C@@H]2O)nc1)C(=O)c1ccc(C)nc1 |r,wU:29.32,7.7,9.12,1.0,wD:33.38,(-7.64,-2.92,;-8.41,-1.59,;-9.96,-1.59,;-10.72,-.25,;-9.96,1.08,;-8.41,1.08,;-7.64,-.25,;-6.1,-.25,;-5.01,.83,;-3.92,-.25,;-5.01,-1.34,;-2.38,-.25,;-1.61,-1.59,;-1.61,1.08,;-.07,1.08,;.83,2.33,;2.3,1.85,;3.63,2.62,;4.97,1.85,;4.97,.31,;3.63,-.46,;2.3,.31,;.83,-.17,;6.3,-.46,;6.3,-2,;7.63,-2.77,;8.97,-2,;10.3,-2.77,;11.63,-2,;12.97,-2.77,;14.43,-2.29,;15.34,-3.54,;14.43,-4.79,;12.97,-4.31,;11.63,-5.08,;8.97,-.46,;7.63,.31,;-12.26,-.25,;-13.03,-1.59,;-13.03,1.08,;-12.26,2.41,;-13.03,3.75,;-14.57,3.75,;-15.34,5.08,;-15.34,2.41,;-14.57,1.08,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.460 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647516
(US20240025893, Example b-04-42)Show SMILES CCCOCc1ncc(cn1)-c1ccc2nc(NC(=O)[C@@H]3C[C@@H](C3)N3CCN(C[C@@H]3C)C(=O)c3cc(C)ccn3)sc2c1 |r,wU:22.25,20.20,29.32,(15.49,-3.85,;14.15,-3.08,;12.82,-3.85,;11.49,-3.08,;10.15,-3.85,;8.82,-3.08,;7.49,-3.85,;6.15,-3.08,;6.15,-1.54,;7.49,-.77,;8.82,-1.54,;4.82,-.77,;4.82,.77,;3.48,1.54,;2.15,.77,;.69,1.25,;-.22,,;-1.76,,;-2.53,-1.33,;-1.76,-2.67,;-4.07,-1.33,;-5.16,-.24,;-6.25,-1.33,;-5.16,-2.42,;-7.79,-1.33,;-8.56,,;-10.11,,;-10.87,-1.33,;-10.11,-2.67,;-8.56,-2.67,;-7.79,-4,;-12.41,-1.33,;-13.18,-2.67,;-13.18,,;-12.41,1.33,;-13.18,2.67,;-12.41,4,;-14.72,2.67,;-15.49,1.33,;-14.72,,;.69,-1.25,;2.15,-.77,;3.48,-1.54,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.490 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647522
(US20240025893, Example b-04-48)Show SMILES C[C@H]1CN(CCN1[C@H]1C[C@H](C1)C(=O)Nc1nc2ccc(cc2s1)-c1cnc(CO[C@H]2CCC[C@@H]2O)nc1)C(=O)c1ccncc1Cl |r,wU:29.32,7.7,9.12,1.0,wD:33.38,(-7.64,-2.25,;-8.41,-.92,;-9.96,-.92,;-10.72,.41,;-9.96,1.75,;-8.41,1.75,;-7.64,.41,;-6.1,.41,;-5.01,1.5,;-3.92,.41,;-5.01,-.68,;-2.38,.41,;-1.61,-.92,;-1.61,1.75,;-.07,1.75,;.83,2.99,;2.3,2.52,;3.63,3.29,;4.97,2.52,;4.97,.98,;3.63,.21,;2.3,.98,;.83,.5,;6.3,.21,;6.3,-1.33,;7.63,-2.1,;8.97,-1.33,;10.3,-2.1,;11.63,-1.33,;12.97,-2.1,;14.43,-1.63,;15.34,-2.87,;14.43,-4.12,;12.97,-3.64,;11.63,-4.41,;8.97,.21,;7.63,.98,;-12.26,.41,;-13.03,-.92,;-13.03,1.75,;-12.26,3.08,;-13.03,4.41,;-14.57,4.41,;-15.34,3.08,;-14.57,1.75,;-15.34,.41,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.520 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647521
(US20240025893, Example b-04-47)Show SMILES C[C@H]1CN(CCN1[C@H]1C[C@H](C1)C(=O)Nc1nc2ccc(cc2s1)-c1cnc(CO[C@H]2CCC[C@@H]2O)nc1)C(=O)c1cc(C)ccn1 |r,wU:29.32,7.7,9.12,1.0,wD:33.38,(-7.64,-2.92,;-8.41,-1.59,;-9.96,-1.59,;-10.72,-.25,;-9.96,1.08,;-8.41,1.08,;-7.64,-.25,;-6.1,-.25,;-5.01,.83,;-3.92,-.25,;-5.01,-1.34,;-2.38,-.25,;-1.61,-1.59,;-1.61,1.08,;-.07,1.08,;.83,2.33,;2.3,1.85,;3.63,2.62,;4.97,1.85,;4.97,.31,;3.63,-.46,;2.3,.31,;.83,-.17,;6.3,-.46,;6.3,-2,;7.63,-2.77,;8.97,-2,;10.3,-2.77,;11.63,-2,;12.97,-2.77,;14.43,-2.29,;15.34,-3.54,;14.43,-4.79,;12.97,-4.31,;11.63,-5.08,;8.97,-.46,;7.63,.31,;-12.26,-.25,;-13.03,-1.59,;-13.03,1.08,;-12.26,2.41,;-13.03,3.75,;-12.26,5.08,;-14.57,3.75,;-15.34,2.41,;-14.57,1.08,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.540 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647520
(US20240025893, Example b-04-46)Show SMILES C[C@H]1CN(CCN1[C@H]1C[C@H](C1)C(=O)Nc1nc2ccc(cc2s1)-c1cnc(CO[C@H]2CCC[C@@H]2O)nc1)C(=O)c1cc(F)ccn1 |r,wU:29.32,7.7,9.12,1.0,wD:33.38,(-7.64,-2.92,;-8.41,-1.59,;-9.96,-1.59,;-10.72,-.25,;-9.96,1.08,;-8.41,1.08,;-7.64,-.25,;-6.1,-.25,;-5.01,.83,;-3.92,-.25,;-5.01,-1.34,;-2.38,-.25,;-1.61,-1.59,;-1.61,1.08,;-.07,1.08,;.83,2.33,;2.3,1.85,;3.63,2.62,;4.97,1.85,;4.97,.31,;3.63,-.46,;2.3,.31,;.83,-.17,;6.3,-.46,;6.3,-2,;7.63,-2.77,;8.97,-2,;10.3,-2.77,;11.63,-2,;12.97,-2.77,;14.43,-2.29,;15.34,-3.54,;14.43,-4.79,;12.97,-4.31,;11.63,-5.08,;8.97,-.46,;7.63,.31,;-12.26,-.25,;-13.03,-1.59,;-13.03,1.08,;-12.26,2.41,;-13.03,3.75,;-12.26,5.08,;-14.57,3.75,;-15.34,2.41,;-14.57,1.08,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.580 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647517
(US20240025893, Example b-04-43)Show SMILES CCCOCc1ncc(cn1)-c1ccc2nc(NC(=O)[C@@H]3C[C@@H](C3)N3CCN(C[C@@H]3C)C(=O)c3ccncc3Cl)sc2c1 |r,wU:22.25,20.20,29.32,(15.49,-3.18,;14.15,-2.41,;12.82,-3.18,;11.49,-2.41,;10.15,-3.18,;8.82,-2.41,;7.49,-3.18,;6.15,-2.41,;6.15,-.87,;7.49,-.1,;8.82,-.87,;4.82,-.1,;4.82,1.44,;3.48,2.21,;2.15,1.44,;.69,1.91,;-.22,.67,;-1.76,.67,;-2.53,-.67,;-1.76,-2,;-4.07,-.67,;-5.16,.42,;-6.25,-.67,;-5.16,-1.76,;-7.79,-.67,;-8.56,.67,;-10.11,.67,;-10.87,-.67,;-10.11,-2,;-8.56,-2,;-7.79,-3.33,;-12.41,-.67,;-13.18,-2,;-13.18,.67,;-12.41,2,;-13.18,3.33,;-14.72,3.33,;-15.49,2,;-14.72,.67,;-15.49,-.67,;.69,-.58,;2.15,-.1,;3.48,-.87,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.650 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647513
(US20240025893, Example b-04-39)Show SMILES C[C@H]1CN(CCN1[C@H]1C[C@H](C1)C(=O)Nc1nc2ccc(cc2s1)-c1cnc(CO[C@H]2CCC[C@@H]2O)nc1)C(=O)c1ccon1 |r,wU:29.32,7.7,9.12,1.0,wD:33.38,(-7.79,-2.11,;-8.56,-.77,;-10.1,-.77,;-10.87,.56,;-10.1,1.9,;-8.56,1.9,;-7.79,.56,;-6.25,.56,;-5.16,1.65,;-4.07,.56,;-5.16,-.53,;-2.53,.56,;-1.76,-.77,;-1.76,1.9,;-.22,1.9,;.69,3.14,;2.15,2.67,;3.49,3.44,;4.82,2.67,;4.82,1.13,;3.49,.36,;2.15,1.13,;.69,.65,;6.15,.36,;6.15,-1.18,;7.49,-1.95,;8.82,-1.18,;10.15,-1.95,;11.49,-1.18,;12.82,-1.95,;14.29,-1.48,;15.19,-2.72,;14.29,-3.97,;12.82,-3.49,;11.49,-4.26,;8.82,.36,;7.49,1.13,;-12.41,.56,;-13.18,-.77,;-13.18,1.9,;-12.7,3.36,;-13.95,4.26,;-15.19,3.36,;-14.72,1.9,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.660 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647519
(US20240025893, Example b-04-45)Show SMILES COc1ccc(cn1)C(=O)N1CCN([C@H]2C[C@H](C2)C(=O)Nc2nc3ccc(cc3s2)-c2cnc(CO[C@H]3CCC[C@@H]3O)nc2)[C@@H](C)C1 |r,wU:36.39,14.14,16.19,44.50,wD:40.45,(-14.35,6.26,;-15.34,5.08,;-14.57,3.75,;-13.03,3.75,;-12.26,2.41,;-13.03,1.08,;-14.57,1.08,;-15.34,2.41,;-12.26,-.25,;-13.03,-1.59,;-10.72,-.25,;-9.96,1.08,;-8.41,1.08,;-7.64,-.25,;-6.1,-.25,;-5.01,.83,;-3.92,-.25,;-5.01,-1.34,;-2.38,-.25,;-1.61,-1.59,;-1.61,1.08,;-.07,1.08,;.83,2.33,;2.3,1.85,;3.63,2.62,;4.97,1.85,;4.97,.31,;3.63,-.46,;2.3,.31,;.83,-.17,;6.3,-.46,;6.3,-2,;7.63,-2.77,;8.97,-2,;10.3,-2.77,;11.63,-2,;12.97,-2.77,;14.43,-2.29,;15.34,-3.54,;14.43,-4.79,;12.97,-4.31,;11.63,-5.08,;8.97,-.46,;7.63,.31,;-8.41,-1.59,;-7.64,-2.92,;-9.96,-1.59,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.660 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647515
(US20240025893, Example b-04-41)Show SMILES CCCOCc1ncc(cn1)-c1ccc2nc(NC(=O)[C@@H]3C[C@@H](C3)N3CCN(C[C@@H]3C)C(=O)c3cc(F)ccn3)sc2c1 |r,wU:22.25,20.20,29.32,(15.49,-3.85,;14.15,-3.08,;12.82,-3.85,;11.49,-3.08,;10.15,-3.85,;8.82,-3.08,;7.49,-3.85,;6.15,-3.08,;6.15,-1.54,;7.49,-.77,;8.82,-1.54,;4.82,-.77,;4.82,.77,;3.48,1.54,;2.15,.77,;.69,1.25,;-.22,,;-1.76,,;-2.53,-1.33,;-1.76,-2.67,;-4.07,-1.33,;-5.16,-.24,;-6.25,-1.33,;-5.16,-2.42,;-7.79,-1.33,;-8.56,,;-10.11,,;-10.87,-1.33,;-10.11,-2.67,;-8.56,-2.67,;-7.79,-4,;-12.41,-1.33,;-13.18,-2.67,;-13.18,,;-12.41,1.33,;-13.18,2.67,;-12.41,4,;-14.72,2.67,;-15.49,1.33,;-14.72,,;.69,-1.25,;2.15,-.77,;3.48,-1.54,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.690 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647498
(US20240025893, Example b-04-24)Show SMILES CCCOCc1ncc(cn1)-c1ccc2nc(NC(=O)[C@@H]3C[C@@H](C3)N3CCN(C[C@@H]3C)C(=O)c3ccccn3)sc2c1 |r,wU:22.25,20.20,29.32,(15.49,-3.18,;14.15,-2.41,;12.82,-3.18,;11.49,-2.41,;10.15,-3.18,;8.82,-2.41,;7.49,-3.18,;6.15,-2.41,;6.15,-.87,;7.49,-.1,;8.82,-.87,;4.82,-.1,;4.82,1.44,;3.48,2.21,;2.15,1.44,;.69,1.91,;-.22,.67,;-1.76,.67,;-2.53,-.67,;-1.76,-2,;-4.07,-.67,;-5.16,.42,;-6.25,-.67,;-5.16,-1.76,;-7.79,-.67,;-8.56,.67,;-10.11,.67,;-10.87,-.67,;-10.11,-2,;-8.56,-2,;-7.79,-3.33,;-12.41,-.67,;-13.18,-2,;-13.18,.67,;-12.41,2,;-13.18,3.33,;-14.72,3.33,;-15.49,2,;-14.72,.67,;.69,-.58,;2.15,-.1,;3.48,-.87,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.760 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM634505
(US20230357271, Example a-01-11)Show SMILES CN1CC[C@H]2C[C@H]1C(=O)NCCCOc1c(ccc3ncc(N2)nc13)-c1cnc(CO)s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.790 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647464
(US20240025893, Example b-02-86)Show SMILES O[C@H]1CCC[C@@H]1OCc1ncc(cn1)-c1ccc2nc(NC(=O)C3CC(C3)NCc3nccs3)sc2c1 |r,wU:5.6,wD:1.0,(10.12,-3.85,;11.46,-3.08,;12.92,-3.56,;13.83,-2.31,;12.92,-1.06,;11.46,-1.54,;10.12,-.77,;8.79,-1.54,;7.46,-.77,;6.12,-1.54,;4.79,-.77,;4.79,.77,;6.12,1.54,;7.46,.77,;3.46,1.54,;3.46,3.08,;2.12,3.85,;.79,3.08,;-.68,3.56,;-1.58,2.31,;-3.12,2.31,;-3.89,.98,;-3.12,-.36,;-5.43,.98,;-6.52,2.07,;-7.61,.98,;-6.52,-.11,;-9.15,.98,;-9.92,-.36,;-11.46,-.36,;-12.36,-1.6,;-13.83,-1.13,;-13.83,.41,;-12.36,.89,;-.68,1.06,;.79,1.54,;2.12,.77,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.803 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647511
(US20240025893, Example b-04-37)Show SMILES C[C@H]1CN(CCN1[C@H]1C[C@H](C1)C(=O)Nc1nc2ccc(cc2s1)-c1cnc(CO[C@H]2CCC[C@@H]2O)nc1)C(=O)c1ccc(Cl)cn1 |r,wU:29.32,7.7,9.12,1.0,wD:33.38,(-7.64,-2.92,;-8.41,-1.59,;-9.96,-1.59,;-10.72,-.25,;-9.96,1.08,;-8.41,1.08,;-7.64,-.25,;-6.1,-.25,;-5.01,.83,;-3.92,-.25,;-5.01,-1.34,;-2.38,-.25,;-1.61,-1.59,;-1.61,1.08,;-.07,1.08,;.83,2.33,;2.3,1.85,;3.63,2.62,;4.97,1.85,;4.97,.31,;3.63,-.46,;2.3,.31,;.83,-.17,;6.3,-.46,;6.3,-2,;7.63,-2.77,;8.97,-2,;10.3,-2.77,;11.63,-2,;12.97,-2.77,;14.43,-2.29,;15.34,-3.54,;14.43,-4.79,;12.97,-4.31,;11.63,-5.08,;8.97,-.46,;7.63,.31,;-12.26,-.25,;-13.03,-1.59,;-13.03,1.08,;-12.26,2.41,;-13.03,3.75,;-14.57,3.75,;-15.34,5.08,;-15.34,2.41,;-14.57,1.08,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.810 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM634536
(US20230357271, Example a-02-16)Show SMILES CN1CC[C@H]2C[C@H]1C(=O)NCC(F)COc1c(ccc3ncc(N2)cc13)-c1cnc(C)nc1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.810 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647569
(US20240025893, Example d-03-06)Show SMILES O[C@H]1CCC[C@@H]1OCc1ncc(cn1)-c1ccc2nc(NC(=O)C3CC4(C3)CCN(CC4)C(=O)c3ccccn3)sc2c1 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.849 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647512
(US20240025893, Example b-04-38)Show SMILES C[C@H]1CN(CCN1[C@H]1C[C@H](C1)C(=O)Nc1nc2ccc(cc2s1)-c1cnc(CO[C@H]2CCC[C@@H]2O)nc1)C(=O)c1cncnc1 |r,wU:29.32,7.7,9.12,1.0,wD:33.38,(-7.64,-2.25,;-8.41,-.92,;-9.96,-.92,;-10.72,.41,;-9.96,1.75,;-8.41,1.75,;-7.64,.41,;-6.1,.41,;-5.01,1.5,;-3.92,.41,;-5.01,-.68,;-2.38,.41,;-1.61,-.92,;-1.61,1.75,;-.07,1.75,;.83,2.99,;2.3,2.52,;3.63,3.29,;4.97,2.52,;4.97,.98,;3.63,.21,;2.3,.98,;.83,.5,;6.3,.21,;6.3,-1.33,;7.63,-2.1,;8.97,-1.33,;10.3,-2.1,;11.63,-1.33,;12.97,-2.1,;14.43,-1.63,;15.34,-2.87,;14.43,-4.12,;12.97,-3.64,;11.63,-4.41,;8.97,.21,;7.63,.98,;-12.26,.41,;-13.03,-.92,;-13.03,1.75,;-12.26,3.08,;-13.03,4.41,;-14.57,4.41,;-15.34,3.08,;-14.57,1.75,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.850 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647570
(US20240025893, Example d-03-07)Show SMILES O[C@H]1CCC[C@@H]1OCc1ncc(cn1)-c1ccc2nc(NC(=O)C3CC4(C3)CCN(CC4)C(=O)c3cccnc3)sc2c1 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.852 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM634549
(US20230357271, Example a-02-09)Show SMILES CC1C[C@H]2C[C@H](N1C)C(=O)NCC(F)COc1c(ccc3ncc(N2)cc13)-c1cnc(C)nc1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.860 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647499
(US20240025893, Example b-04-25)Show SMILES CCCOCc1ncc(cn1)-c1ccc2nc(NC(=O)[C@@H]3C[C@@H](C3)N3CCN(C[C@@H]3C)C(=O)C3CCOC3)sc2c1 |r,wU:22.25,20.20,29.32,(15.34,-3.03,;14.01,-2.26,;12.67,-3.03,;11.34,-2.26,;10.01,-3.03,;8.67,-2.26,;7.34,-3.03,;6,-2.26,;6,-.72,;7.34,.05,;8.67,-.72,;4.67,.05,;4.67,1.59,;3.34,2.36,;2,1.59,;.54,2.06,;-.37,.82,;-1.91,.82,;-2.68,-.52,;-1.91,-1.85,;-4.22,-.52,;-5.31,.57,;-6.39,-.52,;-5.31,-1.61,;-7.93,-.52,;-8.7,.82,;-10.25,.82,;-11.01,-.52,;-10.25,-1.85,;-8.7,-1.85,;-7.93,-3.19,;-12.55,-.52,;-13.32,-1.85,;-13.32,.82,;-12.85,2.28,;-14.09,3.19,;-15.34,2.28,;-14.86,.82,;.54,-.43,;2,.05,;3.34,-.72,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.880 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647604
(US20240025893, Example e-02-23)Show SMILES CCCOCc1ncc(cn1)-c1ccn2nc(NC(=O)[C@@H]3C[C@@H](C3)N3CCN(C[C@@H]3C)C(=O)c3cc(C)nc(C)c3)cc2c1 |r,wU:20.20,22.25,29.32,(16.26,-3.85,;14.92,-3.08,;13.59,-3.85,;12.26,-3.08,;10.92,-3.85,;9.59,-3.08,;8.26,-3.85,;6.92,-3.08,;6.92,-1.54,;8.26,-.77,;9.59,-1.54,;5.59,-.77,;5.59,.77,;4.25,1.54,;2.92,.77,;1.46,1.25,;.55,,;-.99,,;-1.76,-1.33,;-.99,-2.67,;-3.3,-1.33,;-4.39,-.24,;-5.48,-1.33,;-4.39,-2.42,;-7.02,-1.33,;-7.79,,;-9.33,,;-10.1,-1.33,;-9.33,-2.67,;-7.79,-2.67,;-7.02,-4,;-11.64,-1.33,;-12.41,-2.67,;-12.41,,;-11.64,1.33,;-12.41,2.67,;-11.64,4,;-13.95,2.67,;-14.72,1.33,;-16.26,1.33,;-13.95,,;1.46,-1.25,;2.92,-.77,;4.25,-1.54,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.880 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647514
(US20240025893, Example b-04-40)Show SMILES C[C@H]1CN(CCN1[C@H]1C[C@H](C1)C(=O)Nc1nc2ccc(cc2s1)-c1cnc(CO[C@H]2CCC[C@@H]2O)nc1)C(=O)c1cc(C)nc(C)c1 |r,wU:29.32,7.7,9.12,1.0,wD:33.38,(-6.87,-2.92,;-7.64,-1.59,;-9.19,-1.59,;-9.95,-.25,;-9.19,1.08,;-7.64,1.08,;-6.87,-.25,;-5.33,-.25,;-4.24,.83,;-3.15,-.25,;-4.24,-1.34,;-1.61,-.25,;-.84,-1.59,;-.84,1.08,;.7,1.08,;1.6,2.33,;3.07,1.85,;4.4,2.62,;5.74,1.85,;5.74,.31,;4.4,-.46,;3.07,.31,;1.6,-.17,;7.07,-.46,;7.07,-2,;8.4,-2.77,;9.74,-2,;11.07,-2.77,;12.4,-2,;13.74,-2.77,;15.2,-2.29,;16.11,-3.54,;15.2,-4.79,;13.74,-4.31,;12.4,-5.08,;9.74,-.46,;8.4,.31,;-11.49,-.25,;-12.26,-1.59,;-12.26,1.08,;-11.49,2.41,;-12.26,3.75,;-11.49,5.08,;-13.8,3.75,;-14.57,2.41,;-16.11,2.41,;-13.8,1.08,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.890 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM634353
(US20230357271, Example a-01-22)Show SMILES CN1CC[C@H]2C[C@H]1C(=O)NCC(F)(F)COc1c(ccc3ncc(N2)nc13)-c1cnc(CO)s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.890 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM634349
(US20230357271, Example a-01-02)Show SMILES CN1CC[C@H]2C[C@H]1C(=O)NCC1(CC1)COc1c(ccc3ncc(N2)nc13)-c1cnc(CO)s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.890 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647510
(US20240025893, Example b-04-36)Show SMILES C[C@H]1CN(CCN1[C@H]1C[C@H](C1)C(=O)Nc1nc2ccc(cc2s1)-c1cnc(CO[C@H]2CCC[C@@H]2O)nc1)C(=O)c1coc(C)n1 |r,wU:29.32,7.7,9.12,1.0,wD:33.38,(-7.05,-2.11,;-7.82,-.77,;-9.37,-.77,;-10.13,.56,;-9.37,1.9,;-7.82,1.9,;-7.05,.56,;-5.51,.56,;-4.42,1.65,;-3.34,.56,;-4.42,-.53,;-1.8,.56,;-1.03,-.77,;-1.03,1.9,;.51,1.9,;1.42,3.14,;2.88,2.67,;4.22,3.44,;5.55,2.67,;5.55,1.13,;4.22,.36,;2.88,1.13,;1.42,.65,;6.89,.36,;6.89,-1.18,;8.22,-1.95,;9.55,-1.18,;10.89,-1.95,;12.22,-1.18,;13.55,-1.95,;15.02,-1.48,;15.92,-2.72,;15.02,-3.97,;13.55,-3.49,;12.22,-4.26,;9.55,.36,;8.22,1.13,;-11.67,.56,;-12.44,-.77,;-12.44,1.9,;-11.97,3.36,;-13.21,4.26,;-14.46,3.36,;-15.92,3.84,;-13.98,1.9,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.900 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM634528
(US20230357271, Example a-02-12)Show SMILES OCc1ncc(cn1)-c1ccc2ncc3N[C@H]4CCN[C@@H](C4)C(=O)OCCCOc1c2c3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.930 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647465
(US20240025893, Example b-02-87)Show SMILES O[C@H]1CCC[C@@H]1OCc1ncc(cn1)-c1ccc2nc(NC(=O)C3CC(C3)NCc3ccsn3)sc2c1 |r,wU:5.6,wD:1.0,(10.12,-3.85,;11.46,-3.08,;12.92,-3.56,;13.83,-2.31,;12.92,-1.06,;11.46,-1.54,;10.12,-.77,;8.79,-1.54,;7.46,-.77,;6.12,-1.54,;4.79,-.77,;4.79,.77,;6.12,1.54,;7.46,.77,;3.46,1.54,;3.46,3.08,;2.12,3.85,;.79,3.08,;-.68,3.56,;-1.58,2.31,;-3.12,2.31,;-3.89,.98,;-3.12,-.36,;-5.43,.98,;-6.52,2.07,;-7.61,.98,;-6.52,-.11,;-9.15,.98,;-9.92,-.36,;-11.46,-.36,;-12.36,.89,;-13.83,.41,;-13.83,-1.13,;-12.36,-1.6,;-.68,1.06,;.79,1.54,;2.12,.77,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 0.950 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM634526
(US20230357271, Example a-02-11)Show SMILES CCCOCc1ncc(cn1)-c1ccc2ncc3N[C@H]4CCN(CC)[C@@H](C4)C(=O)NCC(F)COc1c2c3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.02 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647581
(US20240025893, Example e-01-03)Show SMILES C[C@@H]1C[C@H]1C(=O)Nc1cc2cc(ccn2n1)-c1cnc(CO[C@H]2CCC[C@@H]2O)nc1 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.03 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647592
(US20240025893, Example e-02-11)Show SMILES CC(C)[C@H]1COCCN1[C@H]1C[C@H](C1)C(=O)Nc1cc2cc(ccn2n1)-c1cnc(CO[C@H]2CCC[C@@H]2O)nc1 |r,wU:11.14,31.34,9.9,3.2,wD:35.40,(-10.75,-2.9,;-9.98,-1.57,;-8.44,-1.57,;-10.75,-.23,;-12.29,-.23,;-13.06,1.1,;-12.29,2.44,;-10.75,2.44,;-9.98,1.1,;-8.44,1.1,;-7.35,2.19,;-6.26,1.1,;-7.35,.01,;-4.72,1.1,;-3.95,-.23,;-3.95,2.44,;-2.41,2.44,;-1.51,1.19,;-.04,1.67,;1.29,.9,;2.62,1.67,;2.62,3.21,;1.29,3.98,;-.04,3.21,;-1.51,3.68,;3.96,.9,;3.96,-.64,;5.29,-1.41,;6.62,-.64,;7.96,-1.41,;9.29,-.64,;10.62,-1.41,;12.03,-.79,;13.06,-1.93,;12.29,-3.27,;10.79,-2.95,;9.64,-3.98,;6.62,.9,;5.29,1.67,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.04 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647462
(US20240025893, Example b-02-84)Show SMILES C[C@@H]1CCCCN1C1CC(C1)C(=O)Nc1nc2ccc(cc2s1)-c1cnc(CO[C@H]2CCC[C@@H]2O)nc1 |r,wU:29.32,wD:33.38,1.0,(-9.95,-1.69,;-10.72,-.36,;-12.26,-.36,;-13.03,.98,;-12.26,2.31,;-10.72,2.31,;-9.95,.98,;-8.41,.98,;-7.32,2.07,;-6.23,.98,;-7.32,-.11,;-4.69,.98,;-3.92,-.36,;-3.92,2.31,;-2.38,2.31,;-1.48,3.56,;-.01,3.08,;1.32,3.85,;2.66,3.08,;2.66,1.54,;1.32,.77,;-.01,1.54,;-1.48,1.06,;3.99,.77,;3.99,-.77,;5.32,-1.54,;6.66,-.77,;7.99,-1.54,;9.32,-.77,;10.66,-1.54,;12.12,-1.06,;13.03,-2.31,;12.12,-3.56,;10.66,-3.08,;9.32,-3.85,;6.66,.77,;5.32,1.54,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.04 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647585
(US20240025893, Example e-02-04)Show SMILES C[C@H]1CN(CC(F)(F)F)CCN1[C@H]1C[C@H](C1)C(=O)Nc1cc2cc(ccn2n1)-c1cnc(CO[C@H]2CCC[C@@H]2O)nc1 |r,wU:14.17,34.37,12.12,1.0,wD:38.43,(-8.83,-1.57,;-9.6,-.23,;-11.14,-.23,;-11.91,1.1,;-13.45,1.1,;-14.22,2.44,;-13.45,3.77,;-15.76,2.44,;-14.99,3.77,;-11.14,2.44,;-9.6,2.44,;-8.83,1.1,;-7.29,1.1,;-6.2,2.19,;-5.11,1.1,;-6.2,.01,;-3.57,1.1,;-2.8,-.23,;-2.8,2.44,;-1.26,2.44,;-.35,1.19,;1.11,1.67,;2.44,.9,;3.78,1.67,;3.78,3.21,;2.44,3.98,;1.11,3.21,;-.35,3.68,;5.11,.9,;5.11,-.64,;6.45,-1.41,;7.78,-.64,;9.11,-1.41,;10.45,-.64,;11.78,-1.41,;13.19,-.79,;14.22,-1.93,;13.45,-3.27,;11.94,-2.95,;10.8,-3.98,;7.78,.9,;6.45,1.67,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.05 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647611
(US20240025893, Example e-04-02)Show SMILES COc1c(ccn2nc(NC(=O)C3CC3)cc12)-c1cnc(CO[C@H]2CCC[C@H]2O)nc1 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.07 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM634535
(US20230357271, Example a-02-02 | US20230357271, Ex...)Show SMILES CCCOCc1ncc(cn1)-c1ccc2ncc3N[C@H]4CCN(C)[C@@H](C4)C(=O)NCC(F)COc1c2c3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.09 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647591
(US20240025893, Example e-02-10)Show SMILES C[C@H]1CN(CCN1[C@H]1C[C@H](C1)C(=O)Nc1cc2cc(ccn2n1)-c1cnc(CO[C@H]2CCC[C@@H]2O)nc1)C(=O)C1CC1 |r,wU:9.12,29.32,7.7,1.0,wD:33.38,(-8.16,-1.57,;-8.93,-.23,;-10.47,-.23,;-11.24,1.1,;-10.47,2.44,;-8.93,2.44,;-8.16,1.1,;-6.62,1.1,;-5.53,2.19,;-4.44,1.1,;-5.53,.01,;-2.9,1.1,;-2.13,-.23,;-2.13,2.44,;-.59,2.44,;.31,1.19,;1.78,1.67,;3.11,.9,;4.44,1.67,;4.44,3.21,;3.11,3.98,;1.78,3.21,;.31,3.68,;5.78,.9,;5.78,-.64,;7.11,-1.41,;8.45,-.64,;9.78,-1.41,;11.11,-.64,;12.45,-1.41,;13.85,-.79,;14.88,-1.93,;14.11,-3.27,;12.61,-2.95,;11.46,-3.98,;8.45,.9,;7.11,1.67,;-12.78,1.1,;-13.55,-.23,;-13.55,2.44,;-13.55,3.98,;-14.88,3.21,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.09 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647590
(US20240025893, Example e-02-09)Show SMILES C[C@H]1CN(CCN1[C@H]1C[C@H](C1)C(=O)Nc1cc2cc(ccn2n1)-c1cnc(CO[C@H]2CCC[C@@H]2O)nc1)C(=O)c1ccccc1 |r,wU:9.12,29.32,7.7,1.0,wD:33.38,(-7.67,-2.13,;-8.44,-.8,;-9.98,-.8,;-10.75,.54,;-9.98,1.87,;-8.44,1.87,;-7.67,.54,;-6.13,.54,;-5.04,1.63,;-3.95,.54,;-5.04,-.55,;-2.41,.54,;-1.64,-.8,;-1.64,1.87,;-.1,1.87,;.8,.63,;2.27,1.1,;3.6,.33,;4.93,1.1,;4.93,2.64,;3.6,3.41,;2.27,2.64,;.8,3.12,;6.27,.33,;6.27,-1.21,;7.6,-1.98,;8.93,-1.21,;10.27,-1.98,;11.6,-1.21,;12.93,-1.98,;14.34,-1.35,;15.37,-2.5,;14.6,-3.83,;13.1,-3.51,;11.95,-4.54,;8.93,.33,;7.6,1.1,;-12.29,.54,;-13.06,-.8,;-13.06,1.87,;-12.29,3.21,;-13.06,4.54,;-14.6,4.54,;-15.37,3.21,;-14.6,1.87,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.09 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647492
(US20240025893, Example b-04-18)Show SMILES CC[C@H]1CN(CCN1C1CC(C1)C(=O)Nc1nc2ccc(cc2s1)-c1cnc(CO[C@H]2CCC[C@@H]2O)nc1)C(=O)C1CCOC1 |r,wU:30.33,2.1,wD:34.39,(-8.56,-3.44,;-7.79,-2.11,;-8.56,-.77,;-10.1,-.77,;-10.87,.56,;-10.1,1.9,;-8.56,1.9,;-7.79,.56,;-6.25,.56,;-5.16,1.65,;-4.07,.56,;-5.16,-.53,;-2.53,.56,;-1.76,-.77,;-1.76,1.9,;-.22,1.9,;.69,3.14,;2.15,2.67,;3.49,3.44,;4.82,2.67,;4.82,1.13,;3.49,.36,;2.15,1.13,;.69,.65,;6.15,.36,;6.15,-1.18,;7.49,-1.95,;8.82,-1.18,;10.15,-1.95,;11.49,-1.18,;12.82,-1.95,;14.29,-1.48,;15.19,-2.72,;14.29,-3.97,;12.82,-3.49,;11.49,-4.26,;8.82,.36,;7.49,1.13,;-12.41,.56,;-13.18,-.77,;-13.18,1.9,;-12.7,3.36,;-13.95,4.26,;-15.19,3.36,;-14.72,1.9,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.11 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM634530
(US20230357271, Example a-02-13)Show SMILES CC(C)N1CC[C@H]2C[C@H]1C(=O)NCC(F)COc1c(ccc3ncc(N2)cc13)-c1cnc(C)nc1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.12 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647494
(US20240025893, Example b-04-20)Show SMILES COc1cccc(n1)C(=O)N1CCN([C@H]2C[C@H](C2)C(=O)Nc2nc3ccc(cc3s2)-c2cnc(CO[C@H]3CCC[C@@H]3O)nc2)[C@@H](C)C1 |r,wU:36.39,14.14,16.19,44.50,wD:40.45,(-16.64,4.53,;-16.11,3.08,;-14.57,3.08,;-13.8,4.41,;-12.26,4.41,;-11.49,3.08,;-12.26,1.75,;-13.8,1.75,;-11.49,.41,;-12.26,-.92,;-9.95,.41,;-9.19,1.75,;-7.64,1.75,;-6.87,.41,;-5.33,.41,;-4.24,1.5,;-3.15,.41,;-4.24,-.68,;-1.61,.41,;-.84,-.92,;-.84,1.75,;.7,1.75,;1.6,2.99,;3.07,2.52,;4.4,3.29,;5.74,2.52,;5.74,.98,;4.4,.21,;3.07,.98,;1.6,.5,;7.07,.21,;7.07,-1.33,;8.4,-2.1,;9.74,-1.33,;11.07,-2.1,;12.4,-1.33,;13.74,-2.1,;15.2,-1.63,;16.11,-2.87,;15.2,-4.12,;13.74,-3.64,;12.4,-4.41,;9.74,.21,;8.4,.98,;-7.64,-.92,;-6.87,-2.25,;-9.19,-.92,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.12 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647586
(US20240025893, Example e-02-05)Show SMILES CCC(=O)N1CCN([C@H]2C[C@H](C2)C(=O)Nc2cc3cc(ccn3n2)-c2cnc(CO[C@H]3CCC[C@@H]3O)nc2)[C@@H](C)C1 |r,wU:10.12,30.32,8.7,38.43,wD:34.38,(-14.99,2.44,;-13.45,2.44,;-12.68,1.1,;-13.45,-.23,;-11.14,1.1,;-10.37,2.44,;-8.83,2.44,;-8.06,1.1,;-6.52,1.1,;-5.43,2.19,;-4.34,1.1,;-5.43,.01,;-2.8,1.1,;-2.03,-.23,;-2.03,2.44,;-.49,2.44,;.42,1.19,;1.88,1.67,;3.21,.9,;4.55,1.67,;4.55,3.21,;3.21,3.98,;1.88,3.21,;.42,3.68,;5.88,.9,;5.88,-.64,;7.22,-1.41,;8.55,-.64,;9.88,-1.41,;11.22,-.64,;12.55,-1.41,;13.96,-.79,;14.99,-1.93,;14.22,-3.27,;12.71,-2.95,;11.57,-3.98,;8.55,.9,;7.22,1.67,;-8.83,-.23,;-8.06,-1.57,;-10.37,-.23,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.14 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM634523
(US20230357271, Example a-01-20)Show SMILES CN1CC[C@H]2C[C@H]1C(=O)OCC(F)COc1c(ccc3ncc(N2)nc13)-c1cnc(C)nc1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.15 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647495
(US20240025893, Example b-04-21)Show SMILES C[C@H]1CN(CCN1[C@H]1C[C@H](C1)C(=O)Nc1nc2ccc(cc2s1)-c1cnc(CO[C@H]2CCC[C@@H]2O)nc1)C(=O)c1cccc(C)n1 |r,wU:29.32,7.7,9.12,1.0,wD:33.38,(-6.87,-2.25,;-7.64,-.92,;-9.19,-.92,;-9.95,.41,;-9.19,1.75,;-7.64,1.75,;-6.87,.41,;-5.33,.41,;-4.24,1.5,;-3.15,.41,;-4.24,-.68,;-1.61,.41,;-.84,-.92,;-.84,1.75,;.7,1.75,;1.6,2.99,;3.07,2.52,;4.4,3.29,;5.74,2.52,;5.74,.98,;4.4,.21,;3.07,.98,;1.6,.5,;7.07,.21,;7.07,-1.33,;8.4,-2.1,;9.74,-1.33,;11.07,-2.1,;12.4,-1.33,;13.74,-2.1,;15.2,-1.63,;16.11,-2.87,;15.2,-4.12,;13.74,-3.64,;12.4,-4.41,;9.74,.21,;8.4,.98,;-11.49,.41,;-12.26,-.92,;-12.26,1.75,;-11.49,3.08,;-12.26,4.41,;-13.8,4.41,;-14.57,3.08,;-16.11,3.08,;-13.8,1.75,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.15 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647600
(US20240025893, Example e-02-19)Show SMILES CCCOCc1ncc(cn1)-c1ccn2nc(NC(=O)[C@@H]3C[C@@H](C3)N3CCN(C[C@@H]3CC)C(=O)C3CCOCC3)cc2c1 |r,wU:20.20,22.25,29.32,(15.49,-2.52,;14.15,-1.75,;12.82,-2.52,;11.49,-1.75,;10.15,-2.52,;8.82,-1.75,;7.48,-2.52,;6.15,-1.75,;6.15,-.21,;7.48,.56,;8.82,-.21,;4.82,.56,;4.82,2.1,;3.48,2.87,;2.15,2.1,;.69,2.58,;-.22,1.33,;-1.76,1.33,;-2.53,,;-1.76,-1.33,;-4.07,,;-5.16,1.09,;-6.25,,;-5.16,-1.09,;-7.79,,;-8.56,1.33,;-10.1,1.33,;-10.87,,;-10.1,-1.33,;-8.56,-1.33,;-7.79,-2.67,;-8.56,-4,;-12.41,,;-13.18,-1.33,;-13.18,1.33,;-12.41,2.67,;-13.18,4,;-14.72,4,;-15.49,2.67,;-14.72,1.33,;.69,.09,;2.15,.56,;3.48,-.21,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.19 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM634449
(US20230357271, Example a-01-23)Show SMILES CCCOCc1ncc(cn1)-c1ccc2ncc3N[C@H]4CCN(C)[C@@H](C4)C(=O)NCC(F)(F)COc1c2n3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.21 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647500
(US20240025893, Example b-04-26)Show SMILES CCCOCc1ncc(cn1)-c1ccc2nc(NC(=O)[C@@H]3C[C@@H](C3)N3CCN(C[C@@H]3C)C(=O)c3ccc(cn3)C(F)(F)F)sc2c1 |r,wU:22.25,20.20,29.32,(15.49,-3.85,;14.15,-3.08,;12.82,-3.85,;11.49,-3.08,;10.15,-3.85,;8.82,-3.08,;7.49,-3.85,;6.15,-3.08,;6.15,-1.54,;7.49,-.77,;8.82,-1.54,;4.82,-.77,;4.82,.77,;3.48,1.54,;2.15,.77,;.69,1.25,;-.22,,;-1.76,,;-2.53,-1.33,;-1.76,-2.67,;-4.07,-1.33,;-5.16,-.24,;-6.25,-1.33,;-5.16,-2.42,;-7.79,-1.33,;-8.56,,;-10.11,,;-10.87,-1.33,;-10.11,-2.67,;-8.56,-2.67,;-7.79,-4,;-12.41,-1.33,;-13.18,-2.67,;-13.18,,;-12.41,1.33,;-13.18,2.67,;-14.72,2.67,;-15.49,1.33,;-14.72,,;-15.49,4,;-14.72,5.33,;-17.03,4,;-16.26,5.33,;.69,-1.25,;2.15,-.77,;3.48,-1.54,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.22 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM634515
(US20230357271, Example a-01-16)Show SMILES CCN1CC[C@H]2C[C@H]1C(=O)NCCCOc1c(ccc3ncc(N2)nc13)-c1cnc(CO)s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.25 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647362
(US20240025893, Example a-01-01 | US20240025893, Ex...)Show SMILES O[C@H]1CCC[C@@H]1OCc1ncc(cn1)-c1ccc2nc(NC(=O)C3CC3)sc2c1 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.26 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647605
(US20240025893, Example e-02-24)Show SMILES C[C@H]1CN(CCN1[C@H]1C[C@H](C1)C(=O)Nc1cc2cc(ccn2n1)-c1cnc(CO[C@H]2CCC[C@@H]2O)nc1)C(=O)c1coc(C)n1 |r,wU:9.12,29.32,7.7,1.0,wD:33.38,(-7.09,-1.98,;-7.86,-.65,;-9.4,-.65,;-10.17,.69,;-9.4,2.02,;-7.86,2.02,;-7.09,.69,;-5.55,.69,;-4.46,1.78,;-3.37,.69,;-4.46,-.4,;-1.83,.69,;-1.06,-.65,;-1.06,2.02,;.48,2.02,;1.39,.78,;2.85,1.25,;4.18,.48,;5.52,1.25,;5.52,2.79,;4.18,3.56,;2.85,2.79,;1.39,3.27,;6.85,.48,;6.85,-1.06,;8.19,-1.83,;9.52,-1.06,;10.85,-1.83,;12.19,-1.06,;13.52,-1.83,;14.93,-1.2,;15.96,-2.35,;15.19,-3.68,;13.68,-3.36,;12.54,-4.39,;9.52,.48,;8.19,1.25,;-11.71,.69,;-12.48,-.65,;-12.48,2.02,;-12,3.49,;-13.25,4.39,;-14.49,3.49,;-15.96,3.96,;-14.02,2.02,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.27 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM634501
(US20230357271, Example a-01-09)Show SMILES CN1CC[C@H]2C[C@H]1C(=O)NCCCOc1c(ccc3ncc(N2)nc13)-c1cncnc1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.28 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647571
(US20240025893, Example d-03-08)Show SMILES O[C@H]1CCC[C@@H]1OCc1ncc(cn1)-c1ccc2nc(NC(=O)C3CC4(C3)CCN(CC(F)(F)F)CC4)sc2c1 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.28 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Interleukin-1 receptor-associated kinase 4
(Homo sapiens (Human)) | BDBM647603
(US20240025893, Example e-02-22)Show SMILES CCCOCc1ncc(cn1)-c1ccn2nc(NC(=O)[C@@H]3C[C@@H](C3)N3CCN(C[C@@H]3C)C(=O)c3ccc(Cl)cn3)cc2c1 |r,wU:20.20,22.25,29.32,(15.49,-3.85,;14.15,-3.08,;12.82,-3.85,;11.49,-3.08,;10.15,-3.85,;8.82,-3.08,;7.49,-3.85,;6.15,-3.08,;6.15,-1.54,;7.49,-.77,;8.82,-1.54,;4.82,-.77,;4.82,.77,;3.48,1.54,;2.15,.77,;.69,1.25,;-.22,,;-1.76,,;-2.53,-1.33,;-1.76,-2.67,;-4.07,-1.33,;-5.16,-.24,;-6.25,-1.33,;-5.16,-2.42,;-7.79,-1.33,;-8.56,,;-10.1,,;-10.87,-1.33,;-10.1,-2.67,;-8.56,-2.67,;-7.79,-4,;-12.41,-1.33,;-13.18,-2.67,;-13.18,,;-12.41,1.33,;-13.18,2.67,;-14.72,2.67,;-15.49,4,;-15.49,1.33,;-14.72,,;.69,-1.25,;2.15,-.77,;3.48,-1.54,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.29 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
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