Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.60 |
| ▸ | POLB | P06746 | 2/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | FBP1 | P09467 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.54 |
| ▸ | PKM | P14618 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | RORB | Q92753 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL30218359 | 0.84 | ALDH1A1 (0.64) | ALDH1A1HSD17B10POLBGAAMAPT | |
| SCHEMBL11324055 | 0.84 | ALDH1A1 (0.56) | ALDH1A1HSD17B10POLBGAAFBP1 | |
| SCHEMBL330400 | 0.83 | ALDH1A1 (0.65) | ALDH1A1HSD17B10POLBGAAMAPT | |
| SCHEMBL27653923 | 0.82 | ALDH1A1 (0.64) | ALDH1A1HSD17B10POLBGAAMAPT | |
| SCHEMBL2762916 | 0.82 | ALDH1A1 (0.64) | ALDH1A1HSD17B10POLBGAAMAPT | |
| SCHEMBL2521905 | 0.81 | ALDH1A1 (0.62) | ALDH1A1HSD17B10POLBGAAMAPT | |
| Hydrochloric Acid SCHEMBL27583076 | 0.81 | ALDH1A1 (0.62) | ALDH1A1HSD17B10POLBGAAMAPT | |
| SCHEMBL28719279 | 0.80 | POLB (0.66) | ALDH1A1HSD17B10POLBGAAMAPT | |
| SCHEMBL27583074 | 0.80 | ALDH1A1 (0.61) | ALDH1A1HSD17B10POLBGAAFBP1 | |
| SCHEMBL28719395 | 0.79 | SMN1; SMN2 (0.51) | ALDH1A1MAPTCYP1A2CYP2C19KDM4E |
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-114057666-B | Synthesis method of 4, 5-disubstituted-2-aminothiazole compound | 沈阳药科大学 | 2023-02-07 | — | — | CN | disclosed |