Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | KLK7 | P49862 | 1/20 | 0.41 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | PARP1 | P09874 | 3/20 | 0.37 |
| ▸ | POLL | Q9UGP5 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.35 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4596639 | 0.82 | EZH2 (0.35) | ALDH1A1GAASMN1; SMN2ATMEZH2 | |
| SCHEMBL4597091 | 0.81 | HTR2A (0.46) | ALDH1A1GAASMN1; SMN2KDM4EPOLL | |
| SCHEMBL15758805 | 0.80 | ALDH1A1 (0.43) | ALDH1A1GAASMN1; SMN2KLK7KLK5 | |
| SCHEMBL4597003 | 0.80 | GPR84 (0.40) | ALDH1A1GAASMN1; SMN2KLK7KLK5 | |
| SCHEMBL4220760 | 0.78 | PRKAB2 (0.48) | ATMEZH2MAP3K14 | |
| SCHEMBL4596514 | 0.78 | CYP1A1 (0.41) | ALDH1A1GAASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL18768108 | 0.77 | AKR1B1 (0.43) | PARP1EZH2HTR1A | |
| SCHEMBL4768067 | 0.77 | KDM4E (0.39) | ALDH1A1GAASMN1; SMN2KLK7KLK5 | |
| SCHEMBL14907125 | 0.75 | TDP1 (0.52) | ALDH1A1GAASMN1; SMN2KLK7KLK5 | |
| SCHEMBL12036045 | 0.74 | PARP1 (0.48) | GAAKLK7KLK5PARP1 |
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-1874750-A1 | DIHYDROBENZOFURANYL ALKANAMINE DERIVATIVES AS 5HT2C AGONISTS | Wyeth Incoporated (US) | 2008-01-09 | — | — | EP | disclosed |
| WO-2007030150-A1 | DIHYDROBENZOFURANYL ALKANAMINE DERIVATIVES AS 5HT2C AGONISTS | WYETH (US) | 2007-03-15 | — | — | WO | disclosed |