Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | AOC3 | Q16853 | 3/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL24017076 | 0.89 | CA1 (0.52) | CA1CA2CA12CA7CA9 | |
| SCHEMBL24017075 | 0.89 | CA1 (0.52) | CA1CA2CA12CA7CA9 | |
| SCHEMBL13462356 | 0.78 | CA1 (0.56) | CA1CA2CA12CA7CA9 | |
| SCHEMBL327954 | 0.78 | CA1 (0.56) | CA1CA2CA12CA7CA9 | |
| SCHEMBL8239398 | 0.78 | CA1 (0.56) | CA1CA2CA12CA7CA9 | |
| SCHEMBL14039828 | 0.77 | AOC3 (0.49) | ALDH1A1TSHRAOC3GAAMAPT | |
| SCHEMBL17465592 | 0.77 | CA1 (0.48) | CA1CA2CA12CA7CA9 | |
| Hydrochloric Acid SCHEMBL3654829 | 0.77 | CA1 (0.55) | CA1CA2CA12CA7CA9 | |
| SCHEMBL1908685 | 0.76 | CA1 (0.52) | CA1CA2CA12CA7CA9 | |
| SCHEMBL13075238 | 0.74 | CYP3A4 (0.41) | ACHEALDH1A1KMT2AAOC3KDM4E |
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-2010131146-A1 | CYCLOBUTENEDIONE DERIVATIVES | PFIZER LIMITED (GB) | 2010-11-18 | — | — | WO | disclosed |