Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 1/20 | 0.37 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.36 |
| ▸ | PDE9A | O76083 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | AOC3 | Q16853 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6068353 | 0.84 | MAP4K4 (0.37) | MAP4K4SMPD3PDE9ATP53PDE10A | |
| SCHEMBL6068358 | 0.78 | SMPD3 (0.38) | MAP4K4SMPD3PDE9ATP53PDE10A | |
| SCHEMBL6068580 | 0.72 | SMPD3 (0.47) | SMPD3 | |
| SCHEMBL5414660 | 0.66 | — | — | |
| SCHEMBL6068622 | 0.66 | PDPK1 (0.36) | SMPD3AOC3 | |
| SCHEMBL6068582 | 0.65 | SMPD3 (0.47) | SMPD3PDE10AGRM2 | |
| SCHEMBL6068751 | 0.62 | SMPD3 (0.33) | SMPD3AOC3 | |
| SCHEMBL23219684 | 0.62 | DRD2 (0.47) | MAP4K4PDE9ATP53 | |
| SCHEMBL19226601 | 0.62 | TP53 (0.44) | MAP4K4TP53PDE10A | |
| SCHEMBL17886516 | 0.61 | TP53 (0.46) | MAP4K4TP53PDE10A |
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 |