Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | PPARA | Q07869 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | GRM8 | O00222 | 1/20 | 0.46 |
| ▸ | GRM6 | O15303 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.43 |
| ▸ | RARB | P10826 | 3/20 | 0.43 |
| ▸ | RARA | P10276 | 1/20 | 0.43 |
| ▸ | RARG | P13631 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3035384 | 0.92 | NR1I2 (0.48) | ALDH1A1PPARAMEN1CYP2D6CYP2C9 | |
| SCHEMBL3212806 | 0.88 | KAT8 (0.58) | ALDH1A1PPARAMEN1CYP2C9CYP2C19 | |
| SCHEMBL3221858 | 0.87 | KAT8 (0.57) | ALDH1A1PPARAMEN1CYP2C9CYP2C19 | |
| SCHEMBL4640677 | 0.83 | HSD17B10 (0.47) | ALDH1A1MEN1CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL15641290 | 0.81 | PPARA (0.54) | ALDH1A1PPARAMEN1CYP2C9KMT2A | |
| SCHEMBL4626521 | 0.80 | HSD17B10 (0.55) | ALDH1A1MEN1CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL10957775 | 0.79 | TP53 (0.54) | ALDH1A1MEN1KMT2ARARBRARA | |
| SCHEMBL10957990 | 0.79 | TP53 (0.54) | ALDH1A1MEN1KMT2ARARBRARA | |
| SCHEMBL10954997 | 0.79 | TP53 (0.54) | ALDH1A1MEN1KMT2ARARBRARA | |
| SCHEMBL10955282 | 0.79 | TP53 (0.54) | ALDH1A1MEN1KMT2ARARBRARA |
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 |
|---|---|---|---|---|---|---|---|
| CN-102877053-B | Water-based metal-surface-treating agent and utilize this inorganic agent to process and the metal material that obtains | NIHON PARKERIZING CO., LTD. (JP) | 2016-05-04 | — | — | CN | disclosed |