Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | APP | P05067 | 1/20 | 0.46 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.46 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Niacin SCHEMBL5465552 | 0.85 | ALDH1A1 (0.49) | KMT2ATDP1LMNAALDH1A1GAA | |
| Niacin SCHEMBL811549 | 0.84 | ALDH1A1 (0.55) | KMT2ATDP1LMNAALDH1A1GAA | |
| Niacin SCHEMBL811046 | 0.79 | LMNA (0.61) | KMT2ATDP1LMNAALDH1A1GAA | |
| Niacin SCHEMBL810780 | 0.79 | KMT2A (0.64) | KMT2ATDP1LMNAALDH1A1GAA | |
| Benzyl Nicotinate SCHEMBL30432197 | 0.78 | TDP1 (0.91) | KMT2ATDP1LMNAALDH1A1GAA | |
| Niacin SCHEMBL6703843 | 0.78 | LMNA (0.63) | KMT2ATDP1LMNAALDH1A1GAA | |
| Niacinamide SCHEMBL580103 | 0.75 | F7 (0.55) | KMT2ATDP1LMNAALDH1A1GAA | |
| Benzyl Nicotinate SCHEMBL24600 | 0.74 | LMNA (1.00) | KMT2ATDP1LMNAALDH1A1GAA | |
| Benzyl Nicotinate SCHEMBL29394048 | 0.74 | LMNA (1.00) | KMT2ATDP1LMNAALDH1A1GAA | |
| Benzyl Nicotinate SCHEMBL29080664 | 0.73 | LMNA (0.97) | KMT2ATDP1LMNAALDH1A1GAA |
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-20070031526-A1 | Topical Deodorant Compositions Based on Hydroxycitric Acid | BIODERM RESEARCH (US) | 2007-02-08 | — | — | US | claimed |