Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ACP3 | P15309 | 1/20 | 0.38 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1789913 | 0.82 | ALDH1A1 (0.47) | CA1CA2ACHECA12CA7 | |
| SCHEMBL5317124 | 0.82 | ALDH1A1 (0.47) | CA1CA2ACHECA12CA7 | |
| SCHEMBL4697867 | 0.77 | L3MBTL1 (0.39) | CA2ALDH1A1TSHRMAPK1TDP1 | |
| SCHEMBL11515799 | 0.75 | ALDH1A1 (0.43) | CA1CA2ACHECA12CA7 | |
| SCHEMBL6447670 | 0.72 | CA1 (0.50) | CA1CA2ACHECA12CA7 | |
| SCHEMBL911096 | 0.71 | CA1 (0.48) | CA1CA2ACHECA12CA7 | |
| SCHEMBL6748628 | 0.70 | CA1 (0.42) | CA1CA2ACHECA12CA7 | |
| SCHEMBL11087707 | 0.70 | AOC3 (0.55) | CA1CA2ACHEALDH1A1TSHR | |
| SCHEMBL8943724 | 0.69 | CA1 (0.47) | CA1CA2CA12CA7CA9 | |
| SCHEMBL27782838 | 0.69 | ALDH1A1 (0.48) | CA1CA2ACHECA12CA7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1404657-A1 | PYRIDAZINONE | Bayer HealthCare AG (DE) | 2004-04-07 | — | — | EP | disclosed |
| WO-2003002541-A1 | PYRIDAZINONE | BAYER HEALTHCARE AG (DE) | 2003-01-09 | — | — | WO | disclosed |