Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.31 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.31 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.31 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.31 |
| ▸ | CASP3 | P42574 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14033957 | 0.79 | — | — | |
| SCHEMBL6850987 | 0.67 | GSK3A (0.44) | PTGS2ALDH1A1NR1H2NR1H3SIRT2 | |
| SCHEMBL2603155 | 0.67 | PTGS2 (0.33) | PTGS2NR1H2NR1H3 | |
| SCHEMBL802733 | 0.65 | ALDH1A1 (0.40) | PTGS2ALDH1A1PKMCASP3 | |
| SCHEMBL11928935 | 0.63 | — | — | |
| SCHEMBL8537 | 0.62 | — | — | |
| SCHEMBL905130 | 0.61 | — | — | |
| SCHEMBL10037339 | 0.59 | — | — | |
| SCHEMBL11960695 | 0.59 | MEN1 (0.33) | ALDH1A1CASP3 | |
| SCHEMBL13865236 | 0.59 | CASP3 (0.36) | CASP3 |
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-9236573-B2 | Organic semiconductor compound, method for preparing same, and organic semiconductor device employing same | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY | 2016-01-12 | — | — | US | disclosed |
| US-20140046013-A1 | ORGANIC SEMICONDUCTOR COMPOUND, METHOD FOR PREPARING SAME, AND ORGANIC SEMICONDUCTOR DEVICE EMPLOYING SAME | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) | 2014-02-13 | — | — | US | disclosed |
| US-20130035464-A1 | Semiconducting Compounds and Devices Incorporating Same | USINVEST LLC | 2013-02-07 | — | — | US | disclosed |