Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA4 | P22748 | 2/20 | 0.39 |
| ▸ | CA6 | P23280 | 2/20 | 0.39 |
| ▸ | CA5A | P35218 | 2/20 | 0.39 |
| ▸ | CA7 | P43166 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL24129793 | 0.82 | CA2 (0.47) | CA2ALDH1A1HPGDGAAL3MBTL1 | |
| SCHEMBL24129426 | 0.82 | CA2 (0.59) | CA2ALDH1A1HPGDUCHL1GAA | |
| SCHEMBL24129791 | 0.81 | CA2 (0.55) | CA2ALDH1A1HPGDUCHL1GAA | |
| SCHEMBL3650831 | 0.81 | CA2 (0.60) | CA2ALDH1A1HPGDUCHL1L3MBTL1 | |
| SCHEMBL24129423 | 0.78 | KMT2A (0.46) | CA2ALDH1A1HPGDUCHL1GAA | |
| SCHEMBL24129790 | 0.77 | KDM4E (0.45) | CA2ALDH1A1HPGDGAAL3MBTL1 | |
| SCHEMBL17674086 | 0.77 | PLCG1 (0.47) | CA2KMT2ACA12CA1CA7 | |
| SCHEMBL31461328 | 0.76 | SMN1; SMN2 (0.44) | CA2ALDH1A1GAAL3MBTL1ATM | |
| SCHEMBL23554860 | 0.74 | CA2 (0.59) | CA2ALDH1A1HPGDUCHL1GAA | |
| SCHEMBL24129455 | 0.73 | TP53 (0.50) | CA2ALDH1A1UCHL1L3MBTL1ATM |
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-2021257614-A1 | HETEROCYCLIC INHIBITORS OF ENPP1 | VOLASTRA THERAPEUTICS, INC. (US) | 2021-12-23 | — | — | WO | disclosed |