Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.31 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5532962 | 1.00 | ALDH1A1 (0.35) | ALDH1A1MAPTTET2CES2ACHE | |
| SCHEMBL775665 | 0.81 | — | — | |
| SCHEMBL18655700 | 0.81 | ALDH1A1 (0.37) | ALDH1A1MAPTTET2CES2ACHE | |
| SCHEMBL21848009 | 0.81 | — | — | |
| SCHEMBL6203909 | 0.78 | DGAT1 (0.30) | — | |
| SCHEMBL6203910 | 0.78 | DGAT1 (0.30) | — | |
| SCHEMBL28097615 | 0.77 | NPSR1 (0.39) | ALDH1A1MAPTCES2ACHECES1 | |
| SCHEMBL4009654 | 0.76 | ALDH1A1 (0.35) | ALDH1A1MAPTTET2 | |
| SCHEMBL71370 | 0.74 | ALDH1A1 (0.39) | ALDH1A1MAPTTET2 | |
| SCHEMBL11938107 | 0.74 | ALDH1A1 (0.36) | ALDH1A1MAPTTET2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018065350-A1 | ORGANIC SEMICONDUCTING COMPOUNDS | MERCK PATENT GMBH (DE) | 2018-04-12 | — | — | WO | disclosed |