Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MITF | O75030 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 2/20 | 0.40 |
| ▸ | PPARG | P37231 | 2/20 | 0.39 |
| ▸ | PPARA | Q07869 | 2/20 | 0.39 |
| ▸ | FNTA | P49354 | 1/20 | 0.38 |
| ▸ | FNTB | P49356 | 1/20 | 0.38 |
| ▸ | SLC6A9 | P48067 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.37 |
| ▸ | FPR2 | P25090 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21514001 | 0.84 | ALDH1A1 (0.45) | ALDH1A1NPSR1MEN1KMT2APPARG | |
| SCHEMBL7171301 | 0.76 | ALDH1A1 (0.45) | ALDH1A1NPSR1LTA4HPPARGPPARA | |
| SCHEMBL2108300 | 0.75 | ALDH1A1 (0.50) | ALDH1A1NPSR1KMT2APPARGPPARA | |
| SCHEMBL2108302 | 0.75 | ALDH1A1 (0.50) | ALDH1A1NPSR1KMT2APPARGPPARA | |
| SCHEMBL4654975 | 0.74 | TBXA2R (0.47) | ALDH1A1NPSR1LTA4HPPARGPPARA | |
| SCHEMBL5684816 | 0.74 | ALDH1A1 (0.41) | ALDH1A1NPSR1LTA4HMAPT | |
| SCHEMBL10878962 | 0.73 | NPSR1 (0.53) | ALDH1A1NPSR1MEN1KMT2ALTA4H | |
| SCHEMBL10878284 | 0.73 | ALDH1A1 (0.44) | ALDH1A1NPSR1PPARGPPARAFPR2 | |
| SCHEMBL11752042 | 0.71 | ALDH1A1 (0.44) | ALDH1A1NPSR1LTA4HPPARGPPARA | |
| SCHEMBL11154253 | 0.71 | CYP1A2 (0.59) | ALDH1A1NPSR1KMT2APPARGPPARA |
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-5700816-A | ANTIARTHRITIC AGENTS | G.D. SEARLE & CO. | 1997-12-23 | — | — | US | claimed |