Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ME2 | P23368 | 1/20 | 0.69 |
| ▸ | ME1 | P48163 | 1/20 | 0.69 |
| ▸ | ME3 | Q16798 | 1/20 | 0.69 |
| ▸ | MAPT | P10636 | 4/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | BACE1 | P56817 | 2/20 | 0.56 |
| ▸ | CA12 | O43570 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 1/20 | 0.55 |
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | CA7 | P43166 | 1/20 | 0.55 |
| ▸ | CA9 | Q16790 | 1/20 | 0.55 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.55 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | PKM | P14618 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL20299548 | 0.98 | ME2 (0.67) | ME2ME1ME3MAPTNPC1 | |
| SCHEMBL9723700 | 0.89 | BACE1 (0.62) | ME2ME1ME3MAPTNPC1 | |
| SCHEMBL13141855 | 0.89 | BACE1 (0.62) | ME2ME1ME3MAPTNPC1 | |
| SCHEMBL13569202 | 0.88 | BACE1 (0.61) | ME2ME1ME3MAPTNPC1 | |
| SCHEMBL13585812 | 0.88 | BACE1 (0.61) | ME2ME1ME3MAPTNPC1 | |
| SCHEMBL29504871 | 0.86 | TDP1 (0.59) | ME2ME1ME3MAPTNPC1 | |
| SCHEMBL29664101 | 0.84 | ME2 (0.62) | ME2ME1ME3MAPTNPC1 | |
| SCHEMBL13642216 | 0.82 | MEN1 (0.56) | ME2ME1ME3MAPTNPC1 | |
| SCHEMBL23084985 | 0.80 | MAPT (0.53) | ME2ME1ME3MAPTNPC1 | |
| SCHEMBL30320677 | 0.79 | ME2 (0.57) | ME2ME1ME3MAPTNPC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4895954-A | Dyeing wool, cellulose | HOECHST AKTIENGESELLSCHAFT (DE) | 1990-01-23 | — | — | US | disclosed |
| US-4588810-A | Basic triphendioxazine dyestuffs | BAYER AKTIENGESELLSCHAFT (DE) | 1986-05-13 | — | — | US | disclosed |
| EP-0148390-A2 | Basic triphendioxazine dyes, their manufacture and their use | BAYER AG (DE) | 1985-07-17 | — | — | EP | disclosed |