Found 120 hits Enz. Inhib. hit(s) with all data for entry = 11680 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)) | BDBM639195
((S)-7-isopropoxy-1-((5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(C#CC3CCNCC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| | n/a | n/a | 1.70 | 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)) | BDBM639244
(1-(((S)-4,4-difluoro-5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(C#CC3CN(C3)C(C)C)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 2 | 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)) | BDBM639196
((S)-7-isopropoxy-4-((1-methylpiperidin-4-yl)ethyny...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(C#CC3CCN(C)CC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 2.30 | 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)) | BDBM639254
((S)-1-((4,4-difluoro-5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(-c3cnn(c3)C3CCN(C)CC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 2.40 | 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)) | BDBM639204
((S)-7-isopropoxy-4-((1-methylazetidin-3-yl)ethynyl...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(C#CC3CN(C)C3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 2.60 | 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)) | BDBM639241
((S)-4-(azetidin-3-ylethynyl)-1-((4,4-difluoro-5-ox...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(C#CC3CNC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 2.80 | 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)) | BDBM639251
(1-(((S)-4,4-difluoro-5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(-c3cnn(c3)[C@@H]3C[C@@H](C3)N(C)C)c2cc1C(N)=O |r,wU:10.9,26.27,28.32,(4.85,5.94,;4.08,4.6,;4.85,3.27,;2.54,4.6,;1.77,3.27,;2.54,1.94,;1.77,.6,;2.54,-.73,;4.08,-.73,;4.85,-2.07,;6.39,-2.07,;7.29,-3.31,;8.76,-2.84,;10.25,-3.23,;9.53,-4.17,;8.76,-1.3,;10.09,-.53,;7.29,-.82,;1.77,-2.07,;.23,-2.07,;-.54,-.73,;-2.08,-.73,;-2.99,.51,;-4.45,.04,;-4.45,-1.5,;-2.99,-1.98,;-5.78,-2.27,;-7.27,-1.87,;-7.67,-3.36,;-6.18,-3.76,;-8.76,-4.45,;-10.25,-4.05,;-8.36,-5.94,;.23,.6,;-.54,1.94,;.23,3.27,;-.54,4.6,;.23,5.94,;-2.08,4.6,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3 | 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)) | BDBM639281
(1-(((R)-1-(2-cyanoacetyl)piperidin-3-yl)oxy)-4-((c...)Show SMILES CC(C)Oc1cc2c(O[C@@H]3CCCN(C3)C(=O)CC#N)ncc(C#C[C@H]3C[C@H](C3)N(C)C)c2cc1C(N)=O |r,wU:9.8,25.25,27.30,(3.4,5.33,;2.63,4,;3.4,2.67,;1.09,4,;.32,2.67,;1.09,1.33,;.32,,;1.09,-1.33,;2.63,-1.33,;3.4,-2.67,;2.63,-4,;3.4,-5.33,;4.94,-5.33,;5.71,-4,;4.94,-2.67,;7.25,-4,;8.02,-2.67,;8.02,-5.33,;9.56,-5.33,;11.1,-5.33,;.32,-2.67,;-1.22,-2.67,;-1.99,-1.33,;-3.53,-1.33,;-5.07,-1.33,;-6.61,-1.33,;-7.7,-2.42,;-8.79,-1.33,;-7.7,-.24,;-10.33,-1.33,;-11.1,-2.67,;-11.1,,;-1.22,,;-1.99,1.33,;-1.22,2.67,;-1.99,4,;-1.22,5.33,;-3.53,4,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3.20 | 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)) | BDBM639203
((S)-4-(azetidin-3-ylethynyl)-7-isopropoxy-1-((5-ox...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(C#CC3CNC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3.30 | 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)) | BDBM639234
((S)-1-((4,4-difluoro-5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(C#CC3CCN(C)CC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3.30 | 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)) | BDBM639233
((S)-1-((4,4-difluoro-5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(C#CC3CCNCC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3.5 | 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)) | BDBM639209
(4-((cis-3-(dimethylamino)cyclobutyl)ethynyl)-7-iso...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(C#C[C@H]3C[C@H](C3)N(C)C)c2cc1C(N)=O |r,wU:10.9,21.21,23.26,(4.63,4.62,;3.86,3.29,;4.63,1.96,;2.32,3.29,;1.55,1.96,;2.32,.62,;1.55,-.71,;2.32,-2.04,;3.86,-2.04,;4.63,-3.38,;6.17,-3.38,;7.07,-4.62,;8.54,-4.15,;8.54,-2.61,;9.87,-1.84,;7.07,-2.13,;1.55,-3.38,;.01,-3.38,;-.76,-2.04,;-2.3,-2.04,;-3.84,-2.04,;-5.38,-2.04,;-6.47,-3.13,;-7.56,-2.04,;-6.47,-.96,;-9.1,-2.04,;-9.87,-3.38,;-9.87,-.71,;.01,-.71,;-.76,.62,;.01,1.96,;-.76,3.29,;.01,4.62,;-2.3,3.29,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3.5 | 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)) | BDBM639256
(1-(((S)-4,4-difluoro-5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(-c3cnn(c3)[C@H]3CC[C@](C)(O)CC3)c2cc1C(N)=O |r,wU:10.9,26.27,29.31,wD:29.32,(4.45,5.94,;3.68,4.6,;4.45,3.27,;2.14,4.6,;1.37,3.27,;2.14,1.94,;1.37,.6,;2.14,-.73,;3.68,-.73,;4.45,-2.07,;5.99,-2.07,;6.9,-3.31,;8.36,-2.84,;9.85,-3.23,;9.13,-4.17,;8.36,-1.3,;9.69,-.53,;6.9,-.82,;1.37,-2.07,;-.17,-2.07,;-.94,-.73,;-2.48,-.73,;-3.38,.51,;-4.85,.04,;-4.85,-1.5,;-3.38,-1.98,;-6.18,-2.27,;-5.78,-3.76,;-6.87,-4.85,;-8.36,-4.45,;-8.76,-5.94,;-9.85,-4.85,;-8.76,-2.96,;-7.67,-1.87,;-.17,.6,;-.94,1.94,;-.17,3.27,;-.94,4.6,;-.17,5.94,;-2.48,4.6,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3.60 | 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)) | BDBM639242
((S)-1-((4,4-difluoro-5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(C#CC3CN(C)C3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3.60 | 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)) | BDBM639237
(1-(((S)-4,4-difluoro-5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CCO[C@H]1CC[C@H](CC1)C#Cc1cnc(OC[C@@H]2CC(F)(F)C(=O)N2)c2cc(OC(C)C)c(cc12)C(N)=O |r,wU:17.17,6.9,3.2,(-11.17,-.28,;-9.63,-.28,;-8.86,-1.62,;-7.32,-1.62,;-6.55,-.28,;-5.01,-.28,;-4.24,-1.62,;-5.01,-2.95,;-6.55,-2.95,;-2.7,-1.62,;-1.16,-1.62,;.38,-1.62,;1.15,-2.95,;2.69,-2.95,;3.46,-1.62,;5,-1.62,;5.77,-2.95,;7.31,-2.95,;8.22,-4.2,;9.68,-3.72,;11.17,-4.12,;10.45,-5.05,;9.68,-2.18,;11.02,-1.41,;8.22,-1.7,;2.69,-.28,;3.46,1.05,;2.69,2.39,;3.46,3.72,;5,3.72,;5.77,5.05,;5.77,2.39,;1.15,2.39,;.38,1.05,;1.15,-.28,;.38,3.72,;1.15,5.05,;-1.16,3.72,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3.90 | 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)) | BDBM639253
((S)-1-((4,4-difluoro-5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(-c3cnn(c3)C3CCNCC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 4 | 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)) | BDBM639180
((S)-4-bromo-1-((4,4-difluoro-5-oxopyrrolidin-2-yl)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(Br)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 4.40 | 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)) | BDBM639226
((S)-1-((4,4-difluoro-5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(C#CC3(O)CCCC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 4.40 | 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)) | BDBM639235
((S)-1-((4,4-difluoro-5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(C#CC3(O)CCN(C)CC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 4.5 | 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)) | BDBM639228
((S)-1-((4,4-difluoro-5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(C#CCC3CCOCC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 4.80 | 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)) | BDBM639221
(4-(1-(cis-3-(dimethylamino)cyclobutyl)-1H-pyrazol-...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(-c3cnn(c3)[C@@H]3C[C@@H](C3)N(C)C)c2cc1C(N)=O |r,wU:10.9,24.25,26.30,(4.97,5.8,;4.2,4.47,;4.97,3.14,;2.66,4.47,;1.89,3.14,;2.66,1.8,;1.89,.47,;2.66,-.86,;4.2,-.86,;4.97,-2.2,;6.51,-2.2,;7.42,-3.44,;8.88,-2.97,;8.88,-1.43,;10.21,-.66,;7.42,-.95,;1.89,-2.2,;.35,-2.2,;-.42,-.86,;-1.96,-.86,;-2.86,.38,;-4.33,-.09,;-4.33,-1.63,;-2.86,-2.11,;-5.66,-2.4,;-7.15,-2.01,;-7.55,-3.49,;-6.06,-3.89,;-8.88,-4.26,;-10.21,-3.49,;-8.88,-5.8,;.35,.47,;-.42,1.8,;.35,3.14,;-.42,4.47,;.35,5.8,;-1.96,4.47,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 5 | 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)) | BDBM639247
((S)-4-(1-cyclopentyl-1H-pyrazol-4-yl)-1-((4,4-difl...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(-c3cnn(c3)C3CCCC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 5.10 | 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)) | BDBM639184
((S)-7-isopropoxy-1-((5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(C#CC3CCOCC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 5.10 | 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)) | BDBM639278
((R)-4-(azetidin-3-ylethynyl)-1-((1-(2-cyanoacetyl)...)Show SMILES CC(C)Oc1cc2c(O[C@@H]3CCCN(C3)C(=O)CC#N)ncc(C#CC3CNC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 5.20 | 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)) | BDBM639182
((S)-4-((3-hydroxyoxetan-3-yl)ethynyl)-7-isopropoxy...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(C#CC3(O)CCC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 5.30 | 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)) | BDBM639229
((S)-1-((4,4-difluoro-5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(C#CC3(O)CCOCC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 5.30 | 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)) | BDBM639192
((S)-4-((4-hydroxy-1-methylpiperidin-4-yl)ethynyl)-...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(C#CC3(O)CCN(C)CC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 5.40 | 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)) | BDBM639207
((S)-7-isopropoxy-4-((1-(methylcarbamoyl)azetidin-3...)Show SMILES CNC(=O)N1CC(C1)C#Cc1cnc(OC[C@@H]2CCC(=O)N2)c2cc(OC(C)C)c(cc12)C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 5.5 | 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)) | BDBM639205
((S)-7-isopropoxy-4-((1-isopropylazetidin-3-yl)ethy...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(C#CC3CN(C3)C(C)C)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 5.60 | 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)) | BDBM639199
(4-((cis-4-ethoxycyclohexyl)ethynyl)-7-isopropoxy-1...)Show SMILES CCO[C@H]1CC[C@H](CC1)C#Cc1cnc(OC[C@@H]2CCC(=O)N2)c2cc(OC(C)C)c(cc12)C(N)=O |r,wU:17.17,6.9,3.2,(-11.09,-.71,;-9.55,-.71,;-8.78,-2.04,;-7.24,-2.04,;-6.47,-.71,;-4.93,-.71,;-4.16,-2.04,;-4.93,-3.38,;-6.47,-3.38,;-2.62,-2.04,;-1.08,-2.04,;.46,-2.04,;1.23,-3.38,;2.77,-3.38,;3.54,-2.04,;5.08,-2.04,;5.85,-3.38,;7.39,-3.38,;8.29,-4.62,;9.76,-4.15,;9.76,-2.61,;11.09,-1.84,;8.29,-2.13,;2.77,-.71,;3.54,.62,;2.77,1.96,;3.54,3.29,;5.08,3.29,;5.85,4.62,;5.85,1.96,;1.23,1.96,;.46,.62,;1.23,-.71,;.46,3.29,;1.23,4.62,;-1.08,3.29,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 5.60 | 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)) | BDBM639231
((S)-1-((4,4-difluoro-5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(C#CC3(O)CCNCC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 6.30 | 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)) | BDBM639206
(US20230391748, Compound I-28 | methyl (S)-3-((6-ca...)Show SMILES COC(=O)N1CC(C1)C#Cc1cnc(OC[C@@H]2CCC(=O)N2)c2cc(OC(C)C)c(cc12)C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 6.30 | 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)) | BDBM639245
((S)-4-(1-cyclopropyl-1H-pyrazol-4-yl)-1-((4,4-difl...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(-c3cnn(c3)C3CC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 6.30 | 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)) | BDBM639208
((S)-4-((3,3-dimethoxycyclobutyl)ethynyl)-7-isoprop...)Show SMILES COC1(CC(C1)C#Cc1cnc(OC[C@@H]2CCC(=O)N2)c2cc(OC(C)C)c(cc12)C(N)=O)OC |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 6.40 | 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)) | BDBM639249
((S)-1-((4,4-difluoro-5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(-c3cnn(CC4CCOCC4)c3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 6.40 | 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)) | BDBM639220
(4-(1-(cis-3-ethoxycyclobutyl)-1H-pyrazol-4-yl)-7-i...)Show SMILES CCO[C@H]1C[C@H](C1)n1cc(cn1)-c1cnc(OC[C@@H]2CCC(=O)N2)c2cc(OC(C)C)c(cc12)C(N)=O |r,wU:18.19,5.7,3.2,(-10.88,-5.03,;-9.55,-4.26,;-8.21,-5.03,;-6.88,-4.26,;-6.48,-2.78,;-5,-3.17,;-5.39,-4.66,;-3.66,-2.4,;-2.2,-2.88,;-1.29,-1.63,;-2.2,-.39,;-3.66,-.86,;.25,-1.63,;1.02,-2.97,;2.56,-2.97,;3.33,-1.63,;4.87,-1.63,;5.64,-2.97,;7.18,-2.97,;8.08,-4.21,;9.55,-3.74,;9.55,-2.2,;10.88,-1.43,;8.08,-1.72,;2.56,-.3,;3.33,1.03,;2.56,2.37,;3.33,3.7,;4.87,3.7,;5.64,5.03,;5.64,2.37,;1.02,2.37,;.25,1.03,;1.02,-.3,;.25,3.7,;1.02,5.03,;-1.29,3.7,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 6.40 | 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)) | BDBM639197
((S)-7-isopropoxy-4-((1-isopropylpiperidin-4-yl)eth...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(C#CC3CCN(CC3)C(C)C)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 6.70 | 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)) | BDBM639248
((S)-1-((4,4-difluoro-5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(-c3cnn(c3)C3CCOCC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 6.80 | 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)) | BDBM639298
(1-(((R)-1-(2-cyanoacetyl)piperidin-3-yl)oxy)-4-(1-...)Show SMILES CCO[C@H]1CC[C@@H](CC1)n1cc(cn1)-c1cnc(O[C@@H]2CCCN(C2)C(=O)CC#N)c2cc(OC(C)C)c(cc12)C(N)=O |r,wU:19.20,6.9,wD:3.2,(-12.09,-6.08,;-11,-4.99,;-9.51,-5.39,;-8.42,-4.3,;-6.94,-4.7,;-5.85,-3.61,;-6.24,-2.13,;-7.73,-1.73,;-8.82,-2.82,;-4.91,-1.36,;-3.45,-1.83,;-2.54,-.59,;-3.45,.66,;-4.91,.18,;-1,-.59,;-.23,-1.92,;1.31,-1.92,;2.08,-.59,;3.62,-.59,;4.39,-1.92,;3.62,-3.25,;4.39,-4.59,;5.93,-4.59,;6.7,-3.25,;5.93,-1.92,;8.24,-3.25,;9.01,-1.92,;9.01,-4.59,;8.24,-5.92,;7.47,-7.25,;1.31,.75,;2.08,2.08,;1.31,3.42,;2.08,4.75,;3.62,4.75,;4.39,6.08,;4.39,3.42,;-.23,3.42,;-1,2.08,;-.23,.75,;-1,4.75,;-.23,6.08,;-2.54,4.75,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 6.80 | 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)) | BDBM639255
(1-(((S)-4,4-difluoro-5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CCO[C@H]1CC[C@@H](CC1)n1cc(cn1)-c1cnc(OC[C@@H]2CC(F)(F)C(=O)N2)c2cc(OC(C)C)c(cc12)C(N)=O |r,wU:20.21,6.9,wD:3.2,(-10.94,-6.08,;-9.85,-4.99,;-8.36,-5.39,;-7.27,-4.3,;-5.78,-4.7,;-4.7,-3.61,;-5.09,-2.13,;-6.58,-1.73,;-7.67,-2.82,;-3.76,-1.36,;-2.3,-1.83,;-1.39,-.59,;-2.3,.66,;-3.76,.18,;.15,-.59,;.92,-1.92,;2.46,-1.92,;3.23,-.59,;4.77,-.59,;5.54,-1.92,;7.08,-1.92,;7.99,-3.17,;9.45,-2.69,;10.94,-3.09,;10.22,-4.02,;9.45,-1.15,;10.78,-.38,;7.99,-.67,;2.46,.75,;3.23,2.08,;2.46,3.42,;3.23,4.75,;4.77,4.75,;5.54,6.08,;5.54,3.42,;.92,3.42,;.15,2.08,;.92,.75,;.15,4.75,;.92,6.08,;-1.39,4.75,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 7 | 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)) | BDBM639198
(4-(((1r,4S)-4-ethoxycyclohexyl)ethynyl)-7-isopropo...)Show SMILES CCO[C@H]1CC[C@@H](CC1)C#Cc1cnc(OC[C@@H]2CCC(=O)N2)c2cc(OC(C)C)c(cc12)C(N)=O |r,wU:17.17,6.9,wD:3.2,(-11.09,-.71,;-9.55,-.71,;-8.78,-2.04,;-7.24,-2.04,;-6.47,-3.38,;-4.93,-3.38,;-4.16,-2.04,;-4.93,-.71,;-6.47,-.71,;-2.62,-2.04,;-1.08,-2.04,;.46,-2.04,;1.23,-3.38,;2.77,-3.38,;3.54,-2.04,;5.08,-2.04,;5.85,-3.38,;7.39,-3.38,;8.29,-4.62,;9.76,-4.15,;9.76,-2.61,;11.09,-1.84,;8.29,-2.13,;2.77,-.71,;3.54,.62,;2.77,1.96,;3.54,3.29,;5.08,3.29,;5.85,4.62,;5.85,1.96,;1.23,1.96,;.46,.62,;1.23,-.71,;.46,3.29,;1.23,4.62,;-1.08,3.29,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 7 | 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)) | BDBM639250
((S)-1-((4,4-difluoro-5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(-c3cnn(CCC4CCOCC4)c3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 7 | 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)) | BDBM639279
((R)-1-((1-(2-cyanoacetyl)piperidin-3-yl)oxy)-7-iso...)Show SMILES CC(C)Oc1cc2c(O[C@@H]3CCCN(C3)C(=O)CC#N)ncc(C#CC3CN(C)C3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 7.10 | 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)) | BDBM639211
((S)-4-(1-cyclobutyl-1H-pyrazol-4-yl)-7-isopropoxy-...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(-c3cnn(c3)C3CCC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 7.5 | 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)) | BDBM639227
((S)-1-((4,4-difluoro-5-oxopyrrolidin-2-yl)methoxy)...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CC(F)(F)C(=O)N3)ncc(C#CC3CCOCC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 7.60 | 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)) | BDBM639225
(US20230391748, Compound I-47 | rrr)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(-c3cn[nH]c3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 7.60 | 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)) | BDBM639212
((S)-4-(1-cyclopentyl-1H-pyrazol-4-yl)-7-isopropoxy...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(-c3cnn(c3)C3CCCC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 7.70 | 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)) | BDBM639290
((R)-1-((1-(2-cyanoacetyl)piperidin-3-yl)oxy)-4-(1-...)Show SMILES CC(C)Oc1cc2c(O[C@@H]3CCCN(C3)C(=O)CC#N)ncc(-c3cnn(c3)C3CCCC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 7.70 | 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)) | BDBM639271
((R)-1-((1-(2-cyanoacetyl)piperidin-3-yl)oxy)-7-iso...)Show SMILES CC(C)Oc1cc2c(O[C@@H]3CCCN(C3)C(=O)CC#N)ncc(C#CC3CCNCC3)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 8 | 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)) | BDBM639202
(US20230391748, Compound I-24 | tert-butyl (S)-3-((...)Show SMILES CC(C)Oc1cc2c(OC[C@@H]3CCC(=O)N3)ncc(C#CC3CN(C3)C(=O)OC(C)(C)C)c2cc1C(N)=O |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 8.10 | 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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