Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CTSD | P07339 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22169196 | 0.78 | CA1 (0.41) | SMN1; SMN2CA1CA2ZDHHC7CA14 | |
| SCHEMBL10606016 | 0.78 | CA1 (0.41) | SMN1; SMN2CA1CA2ZDHHC7CA14 | |
| SCHEMBL188811 | 0.77 | SMN1; SMN2 (0.70) | SMN1; SMN2CA1CA2CA14CA12 | |
| SCHEMBL11687204 | 0.76 | CES2 (0.38) | ALDH1A1HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL9555555 | 0.76 | HDAC1 (0.42) | HDAC3HDAC1HDAC2HDAC8CES2 | |
| SCHEMBL3115358 | 0.74 | CA1 (0.41) | SMN1; SMN2CA1CA2ZDHHC7CA14 | |
| SCHEMBL11085861 | 0.73 | SMN1; SMN2 (0.48) | SMN1; SMN2CA14CA12ALDH1A1CA7 | |
| SCHEMBL30542337 | 0.73 | CES2 (0.39) | ALDH1A1MAPTCES2CES1 | |
| SCHEMBL11469818 | 0.72 | CA1 (0.39) | SMN1; SMN2CA1CA2ZDHHC7ALDH1A1 | |
| SCHEMBL5134249 | 0.72 | CA1 (0.39) | SMN1; SMN2CA1CA2ZDHHC7CA14 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101400408-A | Compositions and methods for eliminating oral malodour | GIVAUDAN SA (CH) | 2009-04-01 | — | — | CN | disclosed |
| CN-101394897-A | Compositions and methods to counteract oral malodour | GIVAUDAN SA (CH) | 2009-03-25 | — | — | CN | disclosed |