Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | MGLL | Q99685 | 1/20 | 0.47 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.41 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | GSK3A | P49840 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29151050 | 1.00 | CA12 (0.47) | CA12CA1CA2CA9MGLL | |
| SCHEMBL29488646 | 0.81 | CA12 (0.49) | CA12CA1CA2CA9MGLL | |
| SCHEMBL29151131 | 0.81 | CA12 (0.49) | CA12CA1CA2CA9MGLL | |
| SCHEMBL29151066 | 0.80 | CA1 (0.60) | CA12CA1CA2CA9MGLL | |
| SCHEMBL25614993 | 0.80 | CA12 (0.45) | CA12CA1CA2CA9SLC6A2 | |
| SCHEMBL29488639 | 0.79 | CA12 (0.47) | CA12CA1CA2CA9MGLL | |
| SCHEMBL10459035 | 0.79 | NPC1 (0.51) | CA12CA1CA2CA9MGLL | |
| SCHEMBL3043828 | 0.77 | CA12 (0.61) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL30745155 | 0.77 | MGLL (0.50) | CA12CA1CA2CA9MGLL | |
| SCHEMBL29151112 | 0.77 | MGLL (0.50) | CA12CA1CA2CA9MGLL |
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-117510470-A | Pyridazinone compounds and application thereof | 暨南大学 | 2024-02-06 | — | — | CN | disclosed |