Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | GPBAR1 | Q8TDU6 | 6/20 | 0.32 |
| ▸ | TACR1 | P25103 | 1/20 | 0.31 |
| ▸ | KIF11 | P52732 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MYC | P01106 | 1/20 | 0.30 |
| ▸ | EDNRB | P24530 | 1/20 | 0.30 |
| ▸ | EDNRA | P25101 | 1/20 | 0.30 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.30 |
| ▸ | FFAR4 | Q5NUL3 | 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 | |
|---|---|---|---|---|
| SCHEMBL4596574 | 0.82 | ALDH1A1 (0.40) | ALDH1A1MAPK1KIF11SMN1; SMN2MYC | |
| SCHEMBL4236359 | 0.82 | GPBAR1 (0.41) | ALDH1A1MAPK1GPBAR1 | |
| SCHEMBL4597135 | 0.82 | GPBAR1 (0.39) | ALDH1A1MAPK1GPBAR1TACR1KIF11 | |
| SCHEMBL4596236 | 0.80 | MYC (0.39) | ALDH1A1MAPK1SMN1; SMN2MYCFFAR1 | |
| SCHEMBL4230959 | 0.80 | AQP1 (0.39) | ALDH1A1MAPK1PTGS1PTGS2GPBAR1 | |
| SCHEMBL15758969 | 0.79 | PARP1 (0.38) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL4596973 | 0.79 | HTR1A (0.41) | ALDH1A1KIF11SMN1; SMN2POLB | |
| SCHEMBL4596391 | 0.78 | OXTR (0.40) | ALDH1A1MAPK1TACR1FFAR1FFAR4 | |
| SCHEMBL4596715 | 0.76 | HTR1A (0.43) | ALDH1A1MAPK1SMN1; SMN2 | |
| SCHEMBL4226843 | 0.76 | PRKAB2 (0.39) | ALDH1A1MAPK1SMN1; SMN2 |
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 |