Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 7/20 | 0.53 |
| ▸ | CA1 | P00915 | 4/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | XBP1 | P17861 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14354723 | 0.73 | CA2 (0.59) | CA2CA1MAPK1ATMGAA | |
| SCHEMBL8411555 | 0.73 | CA2 (0.59) | CA2CA1MAPK1ATMGAA | |
| SCHEMBL1421638 | 0.72 | CA2 (0.68) | CA2CA1MAPK1ATMGAA | |
| SCHEMBL20817496 | 0.72 | CA2 (0.68) | CA2CA1MAPK1ATMGAA | |
| SCHEMBL26104694 | 0.72 | CA2 (0.68) | CA2CA1MAPK1ATMGAA | |
| SCHEMBL11416554 | 0.72 | CA2 (0.73) | CA2CA1MAPK1ATMGAA | |
| SCHEMBL21924959 | 0.72 | CA2 (0.73) | CA2CA1MAPK1ATMGAA | |
| SCHEMBL240950 | 0.72 | CA2 (0.73) | CA2CA1MAPK1ATMGAA | |
| SCHEMBL631533 | 0.72 | CA2 (0.73) | CA2CA1MAPK1ATMGAA | |
| SCHEMBL3181537 | 0.71 | CA2 (0.56) | CA2CA1MAPK1ATMGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-5230802-A | Liquid ion exchanger of alkyl 2,3-bis(alkanoyloxy)butanediote and ion exchange process | PHILIP MORRIS INCORPORATED (US) | 1993-07-27 | — | — | US | disclosed |
| EP-0514201-A1 | Separation process using organic acids and novel organic acids | Philip Morris Products Inc. (US) | 1992-11-19 | — | — | EP | disclosed |