Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.51 |
| ▸ | POLB | P06746 | 3/20 | 0.51 |
| ▸ | PKM | P14618 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 4/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 8/20 | 0.48 |
| ▸ | NPC1 | O15118 | 7/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.48 |
| ▸ | RELA | Q04206 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | DAO | P14920 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL30554642 | 0.97 | DAO (0.50) | ALDH1A1POLBPKMHPGDTP53 | |
| SCHEMBL11883278 | 0.83 | ALDH1A1 (0.51) | ALDH1A1POLBPKMHPGDTP53 | |
| SCHEMBL30554623 | 0.79 | DAO (0.46) | ALDH1A1POLBPKMHPGDTP53 | |
| SCHEMBL13832492 | 0.79 | PNMT (0.48) | PKMGAAALOX15HSD17B10 | |
| SCHEMBL8291574 | 0.79 | NPC1 (0.47) | ALDH1A1POLBPKMHPGDTP53 | |
| SCHEMBL15409702 | 0.79 | ALDH1A1 (0.47) | ALDH1A1POLBPKMHPGDTP53 | |
| SCHEMBL17545266 | 0.78 | PNMT (0.61) | PKMGAAALOX15HSD17B10 | |
| SCHEMBL23657630 | 0.76 | RAB9A (0.64) | ALDH1A1POLBPKMHPGDTP53 | |
| SCHEMBL30554632 | 0.76 | ALDH1A1 (0.46) | ALDH1A1POLBPKMHPGDTP53 | |
| SCHEMBL20852601 | 0.76 | PRMT5 (0.41) | PKMGAACYP1A2CYP2C19ALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005044008-A2 | 2 -AMINOTHIOPHENE COMPOUNDS AS FUNGICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2005-05-19 | — | — | WO | disclosed |