Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | HLCS | P50747 | 2/20 | 0.40 |
| ▸ | S1PR2 | O95136 | 2/20 | 0.38 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.38 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | PRKCA | P17252 | 2/20 | 0.35 |
| ▸ | PRKCD | Q05655 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2780724 | 1.00 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1CYP1A2HLCSS1PR2 | |
| SCHEMBL6036825 | 1.00 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1CYP1A2HLCSS1PR2 | |
| SCHEMBL13082563 | 1.00 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1CYP1A2HLCSS1PR2 | |
| SCHEMBL474085 | 1.00 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1CYP1A2HLCSS1PR2 | |
| SCHEMBL9052248 | 0.98 | ALDH1A1 (0.45) | ALDH1A1L3MBTL1CYP1A2HLCSS1PR2 | |
| SCHEMBL8443031 | 0.98 | ALDH1A1 (0.45) | ALDH1A1L3MBTL1CYP1A2HLCSS1PR2 | |
| SCHEMBL5518415 | 0.98 | ALDH1A1 (0.45) | ALDH1A1L3MBTL1CYP1A2HLCSS1PR2 | |
| SCHEMBL1439579 | 0.85 | — | — | |
| SCHEMBL2365737 | 0.85 | — | — | |
| SCHEMBL1439581 | 0.85 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4960771-A | TRANSDERMAL DELIVERY OF THERAPEUTIC AGENTS; DRUGS, SUNSCREENS, INSECT REPELLENTS, COSMETICS | LVMH MOET HENNESSY LOUIS VUITTON, INC. | 1990-10-02 | — | — | US | disclosed |
| EP-0378657-A1 | OXAZOLIDINONE PENETRATION ENHANCING COMPOUNDS. | RAJADHYAKSHA VITHAL J | 1990-07-25 | — | — | EP | disclosed |
| WO-1990000407-A1 | OXAZOLIDINONE PENETRATION ENHANCING COMPOUNDS | RAJADHYAKSHA VITHAL J (US) | 1990-01-25 | — | — | WO | disclosed |