Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 4/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL365736 | 0.78 | HSD17B10 (0.52) | HSD17B10CA12CA1CA2CA7 | |
| SCHEMBL19025083 | 0.75 | HSD17B10 (0.48) | HSD17B10CA12CA1CA2CA7 | |
| SCHEMBL8738071 | 0.73 | HSD17B10 (0.56) | HSD17B10CA12CA1CA2CA7 | |
| SCHEMBL875312 | 0.73 | ESR1 (0.43) | HSD17B10ALOX15ALOX12ESR1SLC6A2 | |
| SCHEMBL21726735 | 0.72 | IDO1 (0.46) | LMNACHRM2SLC6A2SLC6A3 | |
| Benzene SCHEMBL631929 | 0.72 | HSD17B10 (0.45) | HSD17B10CA12CA1CA2CA7 | |
| SCHEMBL875816 | 0.72 | TYR (0.61) | HSD17B10CA12CA1CA2CA7 | |
| SCHEMBL8763525 | 0.72 | ALOX15 (0.40) | HSD17B10ALOX15ALOX12CYP3A4LMNA | |
| SCHEMBL6131843 | 0.71 | HSD17B10 (0.54) | HSD17B10CA12CA1CA2CA7 | |
| SCHEMBL696050 | 0.71 | HSD17B10 (0.54) | HSD17B10CA12CA1CA2CA7 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110087634-A | Methods of providing oral care benefits | 费丁制药联合股份有限公司 | 2019-08-02 | — | — | CN | disclosed |
| EP-1322738-A2 | HARD SURFACE CLEANING AND DISINFECTING COMPOSITIONS | Reckitt Benckiser Inc. (US) | 2003-07-02 | — | — | EP | disclosed |
| WO-2002026268-A2 | HARD SURFACE CLEANING AND DISINFECTING COMPOSITIONS | RECKITT BENCKISER INC. (US) | 2002-04-04 | — | — | WO | disclosed |