Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | SELL | P14151 | 1/20 | 0.38 |
| ▸ | SELP | P16109 | 1/20 | 0.38 |
| ▸ | WDR5 | P61964 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 3/20 | 0.37 |
| ▸ | CA1 | P00915 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | CA7 | P43166 | 3/20 | 0.37 |
| ▸ | CA9 | Q16790 | 3/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | LDHA | P00338 | 2/20 | 0.36 |
| ▸ | CDC25B | P30305 | 2/20 | 0.36 |
| ▸ | CDC25A | P30304 | 1/20 | 0.36 |
| ▸ | TYMS | P04818 | 1/20 | 0.36 |
| ▸ | LDHB | P07195 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29420737 | 0.93 | CYP1A2 (0.52) | CYP1A2ALDH1A1ALOX15HSD17B10SELL | |
| SCHEMBL48997 | 0.93 | CYP1A2 (0.52) | CYP1A2ALDH1A1ALOX15HSD17B10SELL | |
| SCHEMBL202564 | 0.90 | CYP1A2 (0.50) | CYP1A2ALDH1A1ALOX15HSD17B10SELL | |
| SCHEMBL5549583 | 0.90 | CYP1A2 (0.50) | CYP1A2ALDH1A1ALOX15HSD17B10SELL | |
| SCHEMBL30047473 | 0.84 | CYP1A2 (0.56) | CYP1A2ALDH1A1ALOX15HSD17B10SELL | |
| SCHEMBL499439 | 0.84 | CYP1A2 (0.56) | CYP1A2ALDH1A1ALOX15HSD17B10SELL | |
| SCHEMBL20873437 | 0.83 | CYP1A2 (0.44) | CYP1A2ALDH1A1ALOX15HSD17B10SELL | |
| SCHEMBL30141 | 0.82 | CYP1A2 (0.78) | CYP1A2ALDH1A1ALOX15HSD17B10SELL | |
| SCHEMBL30117300 | 0.82 | CYP1A2 (0.78) | CYP1A2ALDH1A1ALOX15HSD17B10SELL | |
| SCHEMBL9505995 | 0.82 | CYP1A2 (0.61) | CYP1A2ALDH1A1ALOX15HSD17B10WDR5 |
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-0540829-A1 | Novel liquid crystal alignment treating agent | NISSAN CHEMICAL INDUSTRIES LTD. (JP) | 1993-05-12 | — | — | EP | claimed |
| EP-0540829-A1 | Novel liquid crystal alignment treating agent | NISSAN CHEMICAL INDUSTRIES LTD. (JP) | 1993-05-12 | — | — | EP | disclosed |