Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP51A1 | Q16850 | 2/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.38 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| 1-(4-Pyridyl)-1-Butanol SCHEMBL4956036 | 1.00 | CYP51A1 (0.43) | CYP51A1SLC6A2LMNAMAPTMAPK1 | |
| 1-(4-Pyridyl)-1-Butanol SCHEMBL8606540 | 0.98 | CYP51A1 (0.42) | CYP51A1SLC6A2LMNAMAPTMAPK1 | |
| SCHEMBL9603648 | 0.88 | ALDH1A1 (0.45) | CYP51A1MAPTCYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL21633858 | 0.84 | LMNA (0.48) | LMNAALDH1A1RIPK1KDM4EALOX15 | |
| SCHEMBL25314645 | 0.82 | LMNA (0.60) | CYP51A1SLC6A2LMNAMAPTCYP3A4 | |
| SCHEMBL294423 | 0.82 | LMNA (0.60) | CYP51A1SLC6A2LMNAMAPTCYP3A4 | |
| SCHEMBL3822979 | 0.80 | CYP19A1 (0.40) | CYP51A1SLC6A2CYP3A4CYP2C19CYP17A1 | |
| SCHEMBL3183323 | 0.80 | CYP19A1 (0.40) | CYP51A1SLC6A2CYP3A4CYP2C19CYP17A1 | |
| SCHEMBL2382554 | 0.80 | CYP19A1 (0.40) | CYP51A1SLC6A2CYP3A4CYP2C19CYP17A1 | |
| SCHEMBL28553555 | 0.79 | CYP27B1 (0.48) | MAPTCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-7498320-B2 | Cyclic phosphate diesters of 1,3-propane-1-aryl diols and their use in preparing prodrugs | METABASIS THERAPEUTICS, INC. (US) | 2009-03-03 | — | — | US | disclosed |