Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.36 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 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 | |
|---|---|---|---|---|
| SCHEMBL1934657 | 1.00 | TSHR (0.44) | TSHRTDP1CYP3A4MAPTCACNA1B | |
| SCHEMBL27811462 | 0.83 | TSHR (0.47) | TSHRTDP1CYP3A4MAPTALDH1A1 | |
| Alcohol SCHEMBL10342368 | 0.83 | TSHR (0.42) | TSHRTDP1CYP3A4MAPTCACNA1B | |
| SCHEMBL9323925 | 0.83 | TSHR (0.46) | TSHRTDP1CYP3A4MAPTCACNA1B | |
| SCHEMBL10387360 | 0.82 | TSHR (0.37) | TSHRTDP1CYP3A4MAPTCACNA1B | |
| SCHEMBL7395274 | 0.80 | TSHR (0.40) | TSHRTDP1CYP3A4MAPTCACNA1B | |
| SCHEMBL7395272 | 0.80 | TSHR (0.40) | TSHRTDP1CYP3A4MAPTCACNA1B | |
| SCHEMBL1685294 | 0.80 | TSHR (0.51) | TSHRTDP1CYP3A4HPGDCA1 | |
| SCHEMBL873314 | 0.80 | TSHR (0.46) | TSHRTDP1CYP3A4MAPTCACNA1B | |
| SCHEMBL14331822 | 0.80 | TSHR (0.46) | TSHRTDP1CYP3A4MAPTCACNA1B |
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 |
|---|---|---|---|---|---|---|---|
| EP-0299789-B1 | MESOMORPHIC COMPOUND HAVING ALKYL BETA-HYDROXYCARBOXYLATE AS CHIRAL GROUP AND LIQUID CRYSTAL COMPOSITION CONTAINING SAME | MITSUBISHI RAYON CO., LTD. (JP) | 1992-05-20 | — | — | EP | disclosed |
| EP-0299789-A1 | Mesomorphic compound having alkyl beta-hydroxycarboxylate as chiral group and liquid crystal composition containing same | MITSUBISHI RAYON CO., LTD. (JP) | 1989-01-18 | — | — | EP | disclosed |