Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | TSHR | P16473 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | SHBG | P04278 | 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 | |
|---|---|---|---|---|
| Cyclohexanol SCHEMBL28181747 | 0.87 | TSHR (0.50) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| Ether SCHEMBL10784436 | 0.84 | TSHR (0.53) | ALDH1A1TSHRTHRBPOLBKDM4E | |
| Cyclohexanol SCHEMBL11868147 | 0.84 | TSHR (0.53) | ALDH1A1TSHRTHRBPOLBKDM4E | |
| Cyclohexanol SCHEMBL11006996 | 0.84 | TSHR (0.53) | ALDH1A1TSHRTHRBPOLBKDM4E | |
| Cyclohexane SCHEMBL28096195 | 0.84 | ALDH1A1 (0.82) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| Butoxyethanol SCHEMBL28303336 | 0.84 | TSHR (0.65) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| 2-Ethoxyethanol SCHEMBL9805604 | 0.83 | ALDH1A1 (0.58) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| Cyclopentanol SCHEMBL15104612 | 0.80 | TSHR (0.65) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| Biphenyl SCHEMBL11815560 | 0.78 | TSHR (0.46) | ALDH1A1TSHRTHRBSHBG | |
| 2-Ethoxyethanol SCHEMBL107093 | 0.78 | ALDH1A1 (0.56) | ALDH1A1TSHRMEN1KMT2ATHRB |
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 |
|---|---|---|---|---|---|---|---|
| CN-109661734-A | Organic electroluminescent device and method of manufacturing the same | 株式会社LG化学 | 2019-04-19 | — | — | CN | disclosed |