Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL5837930 | 0.84 | ALDH1A1 (0.33) | TP53CYP3A4TDP1ALDH1A1TSHR | |
| SCHEMBL29364269 | 0.84 | ALDH1A1 (0.39) | TP53CYP3A4TDP1ALDH1A1TSHR | |
| SCHEMBL48465 | 0.84 | ALDH1A1 (0.39) | TP53CYP3A4TDP1ALDH1A1TSHR | |
| Ammonia Solution, Strong SCHEMBL9566348 | 0.82 | ALDH1A1 (0.37) | TP53CYP3A4TDP1ALDH1A1TSHR | |
| SCHEMBL2860505 | 0.82 | NPC1 (0.45) | NPC1RAB9ATP53CYP3A4TDP1 | |
| SCHEMBL15256900 | 0.75 | ALDH1A1 (0.32) | TP53CYP3A4TDP1ALDH1A1TSHR | |
| SCHEMBL9184047 | 0.74 | ALDH1A1 (0.40) | TP53CYP3A4TDP1ALDH1A1TSHR | |
| SCHEMBL4910733 | 0.74 | NPC1 (0.36) | NPC1RAB9A | |
| SCHEMBL308607 | 0.73 | NPC1 (0.31) | NPC1RAB9A | |
| SCHEMBL28463583 | 0.73 | NPC1 (0.31) | NPC1RAB9A |
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-5166115-A | Polyurethanes | ALBERMARLE CORPORATION | 1992-11-24 | — | — | US | claimed |