Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.45 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | PRKCA | P17252 | 1/20 | 0.38 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.38 |
| ▸ | RARB | P10826 | 5/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9345586 | 0.94 | ALDH1A1 (0.53) | TSHRALDH1A1PDCD1CD274RARB | |
| SCHEMBL8946795 | 0.91 | ALDH1A1 (0.50) | TSHRALDH1A1LMNACYP3A4HSD17B10 | |
| SCHEMBL7175934 | 0.88 | ALDH1A1 (0.57) | TSHRALDH1A1PDCD1CD274RARB | |
| SCHEMBL7171711 | 0.88 | ALDH1A1 (0.57) | TSHRALDH1A1PDCD1CD274RARB | |
| SCHEMBL7870401 | 0.88 | TSHR (0.56) | TSHRALDH1A1PDCD1CD274LMNA | |
| SCHEMBL9150786 | 0.87 | CA12 (0.54) | TSHRALDH1A1PDCD1CD274LMNA | |
| SCHEMBL9150793 | 0.87 | CA12 (0.54) | TSHRALDH1A1PDCD1CD274LMNA | |
| SCHEMBL14273580 | 0.87 | ALDH1A1 (0.59) | TSHRALDH1A1PDCD1CD274RARB | |
| SCHEMBL9493320 | 0.87 | ALDH1A1 (0.59) | TSHRALDH1A1PDCD1CD274RARB | |
| SCHEMBL7129914 | 0.87 | ALDH1A1 (0.59) | TSHRALDH1A1PDCD1CD274RARB |
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 |
|---|---|---|---|---|---|---|---|
| US-5324451-A | Excellent response and memory | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1994-06-28 | — | — | US | disclosed |
| EP-0329153-B1 | NOVEL LACTIC ACID DERIVATIVES AND LIQUID CRYSTAL COMPOSITIONS CONTAINING THE SAME | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1992-10-21 | — | — | EP | disclosed |
| EP-0329153-A2 | Novel lactic acid derivatives and liquid crystal compositions containing the same | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1989-08-23 | — | — | EP | disclosed |