Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AQP1 | P29972 | 3/20 | 0.44 |
| ▸ | S1PR4 | O95977 | 3/20 | 0.36 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.35 |
| ▸ | METAP1 | P53582 | 1/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.32 |
| ▸ | TRPM5 | Q9NZQ8 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.30 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
| ▸ | SIRT2 | Q8IXJ6 | 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 | |
|---|---|---|---|---|
| SCHEMBL6047924 | 0.93 | AQP1 (0.41) | AQP1S1PR4EZH2HTR2AHTR2C | |
| SCHEMBL4789302 | 0.88 | AQP1 (0.45) | AQP1S1PR4EZH2METAP1HRH4 | |
| SCHEMBL4231582 | 0.87 | AQP1 (0.40) | AQP1S1PR4EZH2METAP1KDM4E | |
| SCHEMBL4831109 | 0.87 | AQP1 (0.40) | AQP1S1PR4EZH2METAP1KDM4E | |
| SCHEMBL4220746 | 0.85 | AQP1 (0.60) | AQP1S1PR4EZH2HRH4HRH3 | |
| SCHEMBL6047906 | 0.83 | AQP1 (0.37) | AQP1EZH2METAP1TRPM5ALDH1A1 | |
| SCHEMBL4220767 | 0.83 | AQP1 (0.64) | AQP1S1PR4EZH2HRH4HRH3 | |
| SCHEMBL4220770 | 0.83 | AQP1 (0.49) | AQP1S1PR4EZH2HRH4HRH3 | |
| SCHEMBL4790052 | 0.83 | AQP1 (0.44) | AQP1S1PR4EZH2HRH4HRH3 | |
| SCHEMBL5142550 | 0.82 | AQP1 (0.49) | AQP1EZH2METAP1HRH4HRH3 |
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-1675840-A1 | DIHYDROBENZOFURANYL ALKANAMINE DERIVATIVES AS 5HT2C AGONISTS | Wyeth a Corporation of the State of Delaware (US) | 2006-07-05 | — | — | EP | disclosed |
| WO-2005044812-A1 | DIHYDROBENZOFURANYL ALKANAMINE DERIVATIVES AS 5HT2C AGONISTS | WYETH A CORPORATION OF THE STATE OF DELAWARE (US) | 2005-05-19 | — | — | WO | disclosed |