Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 2/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA4 | P22748 | 1/20 | 0.52 |
| ▸ | CA6 | P23280 | 1/20 | 0.52 |
| ▸ | CA5A | P35218 | 1/20 | 0.52 |
| ▸ | CA7 | P43166 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.52 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.52 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.48 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.48 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.48 |
| ▸ | VHL | P40337 | 1/20 | 0.46 |
| ▸ | ELOC | Q15369 | 1/20 | 0.46 |
| ▸ | ELOB | Q15370 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | TYR | P14679 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL41775 | 0.89 | TSHR (0.67) | TSHRCA1CA2CA12CA4 | |
| SCHEMBL29413339 | 0.85 | TSHR (0.62) | TSHRCA1CA2CA12CA4 | |
| Benzyl Alcohol SCHEMBL6477897 | 0.84 | TSHR (0.82) | TSHRLTA4HPPARGPPARAHPGD | |
| SCHEMBL31672218 | 0.81 | TSHR (0.59) | TSHRCA1CA2CA12CA4 | |
| SCHEMBL232052 | 0.80 | — | — | |
| SCHEMBL2686386 | 0.80 | TSHR (0.50) | TSHRCA1CA2CA12CA4 | |
| Oxalic Acid SCHEMBL30089202 | 0.80 | TSHR (0.58) | TSHRCA1CA2CA12CA4 | |
| Formic Acid SCHEMBL11392898 | 0.80 | TSHR (0.50) | TSHRCA1CA2CA12CA4 | |
| SCHEMBL238062 | 0.80 | — | — | |
| SCHEMBL7670922 | 0.80 | TSHR (0.50) | TSHRCA1CA2CA12CA4 |
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-5721332-A | REACTING PHENOL, AROMATIC ALDEHYDE AND XYLYLENE COMPOUND | SUMIKIN CHEMICAL CO., LTD. (JP) | 1998-02-24 | — | — | US | disclosed |