Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | DNTT | P04053 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 1/20 | 0.30 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.30 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL78032 | 1.00 | CYP3A4 (0.37) | CYP3A4CYP2C9CYP2C19ELANEALDH1A1 | |
| SCHEMBL28551968 | 1.00 | CYP3A4 (0.37) | CYP3A4CYP2C9CYP2C19ELANEALDH1A1 | |
| SCHEMBL316918 | 0.86 | PPARG (0.34) | CYP3A4CYP2C9CYP2C19ALDH1A1L3MBTL1 | |
| SCHEMBL27560805 | 0.85 | CYP3A4 (0.33) | CYP3A4CYP2C9CYP2C19ALDH1A1L3MBTL1 | |
| SCHEMBL3798470 | 0.85 | CYP3A4 (0.33) | CYP3A4CYP2C9CYP2C19ALDH1A1L3MBTL1 | |
| Hexadecane SCHEMBL28128441 | 0.85 | CYP3A4 (0.33) | CYP3A4CYP2C9CYP2C19ALDH1A1L3MBTL1 | |
| SCHEMBL38982 | 0.85 | CYP3A4 (0.33) | CYP3A4CYP2C9CYP2C19ALDH1A1L3MBTL1 | |
| SCHEMBL3224833 | 0.85 | CYP3A4 (0.33) | CYP3A4CYP2C9CYP2C19ALDH1A1L3MBTL1 | |
| SCHEMBL13072064 | 0.85 | CYP2C19 (0.36) | CYP2C19ALDH1A1 | |
| SCHEMBL7584096 | 0.83 | CYP2C9 (0.40) | CYP3A4CYP2C9CYP2C19CYSLTR2CYSLTR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005059011-A1 | MELAMINE RESIN DISPERSION | AMI AGROLINZ MELAMINE INTERNATIONAL GMBH (AT) | 2005-06-30 | — | — | WO | disclosed |