Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPIA | P62937 | 4/20 | 0.76 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.73 |
| ▸ | MAPT | P10636 | 1/20 | 0.73 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.73 |
| ▸ | TSHR | P16473 | 1/20 | 0.69 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.69 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.68 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.65 |
| ▸ | HTT | P42858 | 1/20 | 0.61 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.59 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | EDNRB | P24530 | 2/20 | 0.58 |
| ▸ | EDNRA | P25101 | 2/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL6665288 | 0.96 | TSHR (0.77) | PPIAALDH1A1MAPTADRA1ATSHR | |
| SCHEMBL12879697 | 0.87 | ALDH1A1 (0.77) | PPIAALDH1A1MAPTADRA1ATSHR | |
| SCHEMBL31469213 | 0.84 | ALDH1A1 (0.73) | PPIAALDH1A1MAPTADRA1ATSHR | |
| SCHEMBL6667090 | 0.84 | ALDH1A1 (0.73) | PPIAALDH1A1MAPTADRA1ATSHR | |
| Sulfamethoxazole SCHEMBL3656 | 0.84 | ALDH1A1 (1.00) | PPIAALDH1A1MAPTADRA1ATSHR | |
| Sulfamethoxazole SCHEMBL6896861 | 0.84 | ALDH1A1 (1.00) | PPIAALDH1A1MAPTADRA1ATSHR | |
| SCHEMBL1027519 | 0.84 | TSHR (0.83) | PPIAALDH1A1MAPTADRA1ATSHR | |
| Sulfamethoxazole SCHEMBL1368068 | 0.83 | ALDH1A1 (0.97) | PPIAALDH1A1MAPTADRA1ATSHR | |
| Sulfamethoxazole SCHEMBL5870744 | 0.83 | ALDH1A1 (0.97) | PPIAALDH1A1MAPTADRA1ATSHR | |
| Sulfamethoxazole SCHEMBL22467841 | 0.83 | ALDH1A1 (0.97) | PPIAALDH1A1MAPTADRA1ATSHR |
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-2004092123-A2 | INHIBITORS OF FUNGAL INVASION | MICROBIA, INC. (US) | 2004-10-28 | — | — | WO | disclosed |