Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | SMPD3 | Q9NY59 | 3/20 | 0.34 |
| ▸ | CNR2 | P34972 | 4/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.34 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
| ▸ | CCR6 | P51684 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6068751 | 0.81 | SMPD3 (0.33) | SMPD3CNR2LRRK2AOC3 | |
| SCHEMBL6068715 | 0.76 | CNR2 (0.38) | PDPK1SMPD3CNR2LRRK2AOC3 | |
| SCHEMBL5424987 | 0.70 | HCAR3 (0.34) | — | |
| SCHEMBL6068366 | 0.69 | SMPD3 (0.39) | SMPD3CNR2LRRK2AOC3 | |
| SCHEMBL15651641 | 0.69 | HCAR3 (0.33) | — | |
| SCHEMBL15651434 | 0.69 | HCAR3 (0.33) | — | |
| SCHEMBL5020886 | 0.69 | HCAR3 (0.33) | — | |
| Bromide SCHEMBL6068466 | 0.69 | SMPD3 (0.38) | SMPD3CNR2LRRK2AOC3 | |
| Bromide SCHEMBL6068862 | 0.69 | SMPD3 (0.38) | SMPD3CNR2LRRK2AOC3 | |
| SCHEMBL6068593 | 0.67 | SIGMAR1 (0.40) | SMPD3 |
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 |
|---|---|---|---|---|---|---|---|
| US-7091350-B2 | Diaminopyrazole derivatives and their use for oxidation dyeing of keratinous fibres | L'OREAL (FR) | 2006-08-15 | — | — | US | disclosed |