Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 2/20 | 0.39 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.37 |
| ▸ | PHGDH | O43175 | 1/20 | 0.37 |
| ▸ | ACACB | O00763 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1760976 | 0.87 | PHGDH (0.43) | SCN9ALPAR2PHGDHACACBDRD2 | |
| SCHEMBL2930872 | 0.84 | TRPV1 (0.40) | SCN9APHGDHACACBTRPV1ADORA2A | |
| SCHEMBL2932003 | 0.77 | LIMK1 (0.37) | TRPV1ADORA2AADORA1EGFR | |
| SCHEMBL3041508 | 0.76 | PHGDH (0.47) | SCN9APHGDHADORA2AMAPT | |
| Trifluoroacetic Acid SCHEMBL2933045 | 0.76 | ADORA2A (0.34) | ADORA3ADORA2AADORA1MAPTACHE | |
| SCHEMBL2929996 | 0.75 | PKLR (0.38) | LPAR2ACACBTRPV1ADORA3ADORA2A | |
| SCHEMBL2930871 | 0.75 | ADORA2A (0.49) | DRD2TRPV1ADORA2AADORA1 | |
| SCHEMBL2925732 | 0.75 | EIF4E (0.37) | ADORA3ADORA2AADORA1MAPT | |
| SCHEMBL2927982 | 0.75 | ADORA2B (0.47) | PHGDHADORA2AADORA1 | |
| SCHEMBL2931313 | 0.75 | LRRK2 (0.38) | ADORA2AADORA1PIK3CD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2027132-B1 | THIAZOLO-PYRAMIDINE / PYRIDINE UREA DERIVATIVES AS ADENOSINE A2B RECEPTOR ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2010-09-15 | — | — | EP | claimed |