Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL866141 | 0.95 | CYP1A2 (0.31) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| SCHEMBL28634989 | 0.72 | ALOX15 (0.39) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| SCHEMBL28634991 | 0.72 | ALOX15 (0.39) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| SCHEMBL867333 | 0.71 | LMNA (0.37) | — | |
| SCHEMBL21465029 | 0.69 | TSHR (0.39) | — | |
| SCHEMBL16878867 | 0.68 | ALOX15 (0.39) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| SCHEMBL28017570 | 0.68 | ALOX15 (0.39) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| SCHEMBL867117 | 0.68 | CHRM2 (0.34) | — | |
| SCHEMBL13367959 | 0.66 | — | — | |
| SCHEMBL8131724 | 0.66 | — | — |
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-2144951-A1 | THERMALLY STABLE ALIGNMENT MATERIALS | Rolic AG (CH) | 2010-01-20 | — | — | EP | disclosed |
| WO-2008135131-A1 | THERMALLY STABLE ALIGNMENT MATERIALS | ROLIC AG (CH) | 2008-11-13 | — | — | WO | disclosed |