Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.40 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.40 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.39 |
| ▸ | FEN1 | P39748 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 4/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.36 |
| ▸ | CBFB | Q13951 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5012098 | 0.81 | PDE4A (0.44) | PDE4APDE4BPDE4CPDE4DCHEK1 | |
| SCHEMBL8538740 | 0.79 | NISCH (0.46) | PDE4APDE4BPDE4CPDE4DKDM4E | |
| SCHEMBL27481658 | 0.79 | MRGPRX4 (0.43) | DGAT1KCNH2MRGPRX4ALOX5APFEN1 | |
| SCHEMBL18988980 | 0.77 | MPL (0.44) | MRGPRX4ALOX5APFEN1DYRK1BCBFB | |
| SCHEMBL29755488 | 0.77 | MPL (0.44) | MRGPRX4ALOX5APFEN1DYRK1BCBFB | |
| SCHEMBL2651232 | 0.73 | CSNK1A1 (0.49) | PDE4APDE4BPDE4CPDE4DDYRK1B | |
| SCHEMBL22937852 | 0.72 | MRGPRX4 (0.73) | MRGPRX4 | |
| Hydrochloric Acid SCHEMBL5855000 | 0.72 | CSNK1A1 (0.47) | PDE4APDE4BPDE4CPDE4DDYRK1B | |
| SCHEMBL29876988 | 0.72 | KIF11 (0.53) | DGAT1SOAT1KCNH2ALOX5APFEN1 | |
| SCHEMBL1239841 | 0.70 | ADRA2A (0.46) | PDE4APDE4BPDE4CPDE4DDYRK1B |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2552888-A1 | \"TRPV1 VANILLOID RECEPTOR ANTAGONISTS WITH A BICYCLIC PORTION\ | Pharmeste S.r.l. (IT) | 2013-02-06 | — | — | EP | disclosed |
| WO-2011120604-A1 | \"TRPV1 VANILLOID RECEPTOR ANTAGONISTS WITH A BICYCLIC PORTION\ | PHARMESTE S.R.L. (IT) | 2011-10-06 | — | — | WO | disclosed |