Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 10/20 | 0.49 |
| ▸ | CA2 | P00918 | 10/20 | 0.49 |
| ▸ | CA9 | Q16790 | 8/20 | 0.49 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3816056 | 0.79 | CA1 (0.56) | ALDH1A1CA1CA2CA9CA12 | |
| SCHEMBL7570371 | 0.77 | ALDH1A1 (0.64) | ALDH1A1CA1CA2CA9CA12 | |
| SCHEMBL11358245 | 0.75 | CA1 (0.53) | ALDH1A1CA1CA2CA9CA12 | |
| SCHEMBL8779843 | 0.74 | NPC1 (0.42) | ALDH1A1CA1CA2CA9CA12 | |
| SCHEMBL4463532 | 0.73 | CA1 (0.70) | ALDH1A1CA1CA2CA9CA12 | |
| SCHEMBL31309573 | 0.73 | CA1 (0.70) | ALDH1A1CA1CA2CA9CA12 | |
| SCHEMBL27575211 | 0.72 | CA1 (0.54) | ALDH1A1CA1CA2CA9CA12 | |
| SCHEMBL20441085 | 0.71 | CA2 (0.46) | ALDH1A1CA1CA2CA9CA12 | |
| SCHEMBL11383168 | 0.71 | CA1 (0.51) | ALDH1A1CA1CA2CA9CA12 | |
| SCHEMBL10797625 | 0.70 | CA1 (0.47) | ALDH1A1CA1CA2CA9NPC1 |
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-2002062769-A2 | PREPARATION AND PURIFICATION OF ANTIVIRAL DISULFONIC ACID DISODIUM SALT | WYETH (US) | 2002-08-15 | — | — | WO | disclosed |