Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MYC | P01106 | 1/20 | 0.37 |
| ▸ | TYMS | P04818 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.32 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | DPP4 | P27487 | 1/20 | 0.30 |
| ▸ | PDK2 | Q15119 | 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 | |
|---|---|---|---|---|
| SCHEMBL5583785 | 0.87 | ALDH1A1 (0.37) | ALDH1A1MYCHTR7ACHEMAP3K14 | |
| SCHEMBL4609397 | 0.69 | NOTUM (0.37) | ALDH1A1PDK2 | |
| SCHEMBL4596846 | 0.68 | KDM4E (0.43) | ALDH1A1ACHE | |
| SCHEMBL28899579 | 0.67 | MYC (0.58) | ALDH1A1MYCCA1CA2CA7 | |
| SCHEMBL4596842 | 0.67 | ACHE (0.37) | MYCTYMSCA1CA2CA7 | |
| SCHEMBL4223650 | 0.66 | PRKAB2 (0.37) | MYCTYMSHTR7ACHE | |
| SCHEMBL12043452 | 0.65 | MAP3K14 (0.33) | ALDH1A1CA1CA2CA7CA9 | |
| SCHEMBL1133067 | 0.65 | MYC (0.56) | ALDH1A1MYCCA1CA2CA7 | |
| SCHEMBL4962170 | 0.65 | HTR2A (0.31) | — | |
| SCHEMBL4161420 | 0.65 | CA1 (0.48) | ALDH1A1MYCCA1CA2CA7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2007509174-A | — | — | 2007-04-12 | — | — | JP | claimed |
| EP-1675840-A1 | DIHYDROBENZOFURANYL ALKANAMINE DERIVATIVES AS 5HT2C AGONISTS | Wyeth a Corporation of the State of Delaware (US) | 2006-07-05 | — | — | EP | claimed |
| WO-2005044812-A1 | DIHYDROBENZOFURANYL ALKANAMINE DERIVATIVES AS 5HT2C AGONISTS | WYETH A CORPORATION OF THE STATE OF DELAWARE (US) | 2005-05-19 | — | — | WO | claimed |