Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AQP1 | P29972 | 3/20 | 0.37 |
| ▸ | TRPM5 | Q9NZQ8 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 2/20 | 0.32 |
| ▸ | HTR7 | P34969 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | ALPG | P10696 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
| ▸ | METAP1 | P53582 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6047925 | 0.83 | AQP1 (0.44) | AQP1TRPM5EZH2MAPTALDH1A1 | |
| SCHEMBL4225800 | 0.83 | AQP1 (0.53) | AQP1PTGS1PTGS2EZH2MAPT | |
| SCHEMBL4234651 | 0.81 | AQP1 (0.43) | AQP1PTGS1PTGS2EZH2 | |
| SCHEMBL4234649 | 0.81 | AQP1 (0.57) | AQP1PTGS1PTGS2EZH2KMT2A | |
| SCHEMBL6047897 | 0.79 | GSK3B (0.38) | PTGS1MAPTALDH1A1 | |
| SCHEMBL4226548 | 0.78 | PRKAB2 (0.47) | AQP1PTGS1PTGS2MEN1KMT2A | |
| SCHEMBL4230146 | 0.78 | MAPT (0.36) | AQP1PTGS1PTGS2MEN1KMT2A | |
| SCHEMBL6047924 | 0.77 | AQP1 (0.41) | AQP1EZH2HTR7 | |
| SCHEMBL4597074 | 0.77 | BRD4 (0.39) | AQP1PTGS1PTGS2HTR1A | |
| SCHEMBL4225639 | 0.76 | AQP1 (0.49) | AQP1EZH2MEN1KMT2AMAPT |
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 |