Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.38 |
| ▸ | PHGDH | O43175 | 1/20 | 0.37 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.36 |
| ▸ | NCS1 | P62166 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.34 |
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1760948 | 0.86 | PHGDH (0.43) | TRPV1SCN9APHGDHCSNK1DADORA2A | |
| SCHEMBL2924809 | 0.84 | SCN9A (0.39) | TRPV1SCN9APHGDHADORA2AACACB | |
| SCHEMBL2932003 | 0.81 | LIMK1 (0.37) | TRPV1ADORA2A | |
| SCHEMBL3041508 | 0.81 | PHGDH (0.47) | SCN9APHGDHADORA2A | |
| SCHEMBL2930871 | 0.80 | ADORA2A (0.49) | TRPV1ADORA2A | |
| SCHEMBL2927982 | 0.79 | ADORA2B (0.47) | PHGDHADORA2A | |
| SCHEMBL2932713 | 0.79 | ADORA2A (0.49) | ADORA2A | |
| SCHEMBL2931382 | 0.79 | ADORA2A (0.41) | TRPV1ADORA2A | |
| SCHEMBL2932276 | 0.79 | CYP2D6 (0.41) | TRPV1ADORA2A | |
| SCHEMBL2931791 | 0.78 | RPS6KB1 (0.37) | TRPV1ADORA2A |
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 |