| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 19th, 2008 | 29 | No |
Popular Name: Interleukin-1Receptor-Associated-Kinase-1/4Inhibitor Interleukin-1Receptor-Associated…
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CAS Number: 509093-47-4
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.70 | 9.18 | -15.22 | 1 | 9 | 0 | 108 | 395.419 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.70 | 10.56 | -40.11 | 2 | 9 | 1 | 110 | 396.427 | 5 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| IRAK1-1-E | Interleukin-1 Receptor-associated Kinase 1 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 300 | 0.31 | Binding ≤ 10μM |
| IRAK4-1-E | Interleukin-1 Receptor-associated Kinase 4 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 200 | 0.32 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| IRAK1_HUMAN | P51617 | Interleukin-1 Receptor-associated Kinase 1, Human | 300 | 0.31 | Binding ≤ 1μM |
| IRAK4_HUMAN | Q9NWZ3 | Interleukin-1 Receptor-associated Kinase 4, Human | 200 | 0.32 | Binding ≤ 1μM |
| IRAK1_HUMAN | P51617 | Interleukin-1 Receptor-associated Kinase 1, Human | 300 | 0.31 | Binding ≤ 10μM |
| IRAK4_HUMAN | Q9NWZ3 | Interleukin-1 Receptor-associated Kinase 4, Human | 200 | 0.32 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| activated TAK1 mediates p38 MAPK activation | |
| Interleukin-1 signaling | |
| IRAK1 recruits IKK complex | |
| IRAK1 recruits IKK complex upon TLR7/8 or 9 stimulation | |
| JNK (c-Jun kinases) phosphorylation and activation mediated by activated human | |
| MyD88 cascade initiated on plasma membrane | |
| MyD88 dependent cascade initiated on endosome | |
| MyD88:Mal cascade initiated on plasma membrane | |
| NF-kB is activated and signals survival | |
| NOD1/2 Signaling Pathway | |
| p75NTR recruits signalling complexes | |
| TAK1 activates NFkB by phosphorylation and activation of IKKs complex | |
| TRAF6 mediated induction of NFkB and MAP kinases upon TLR7/8 or 9 activation | |
| TRAF6 mediated IRF7 activation in TLR7/8 or 9 signaling |
No pre-computed analogs available. Try a structural similarity search.