Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.37 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 7/20 | 0.35 |
| ▸ | GHSR | Q92847 | 2/20 | 0.35 |
| ▸ | CACNA1H | O95180 | 3/20 | 0.35 |
| ▸ | CCR2 | P41597 | 1/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL1882565 | 1.00 | LTA4H (0.37) | LTA4HPRKD1HRH3CACNA1BGHSR | |
| Trifluoroacetic Acid SCHEMBL1879960 | 0.88 | HDAC1 (0.39) | LTA4HHRH3CACNA1BCACNA1H | |
| Trifluoroacetic Acid SCHEMBL1876885 | 0.88 | HDAC1 (0.39) | LTA4HHRH3CACNA1BCACNA1H | |
| Trifluoroacetic Acid SCHEMBL1879078 | 0.88 | SCN9A (0.41) | LTA4HCACNA1BGHSRCACNA1HCCR2 | |
| Trifluoroacetic Acid SCHEMBL1878705 | 0.87 | CCR2 (0.37) | LTA4HCACNA1BGHSRCACNA1HCCR2 | |
| SCHEMBL12634019 | 0.83 | MMP12 (0.42) | HRH3GHSR | |
| SCHEMBL12634069 | 0.83 | MMP12 (0.42) | HRH3GHSR | |
| Trifluoroacetic Acid SCHEMBL1874603 | 0.83 | SLC2A1 (0.42) | CACNA1BCACNA1H | |
| Trifluoroacetic Acid SCHEMBL1875501 | 0.82 | CACNA1B (0.37) | LTA4HCACNA1BCACNA1H | |
| Trifluoroacetic Acid SCHEMBL1876615 | 0.82 | PTPN2 (0.38) | CACNA1BGHSRCACNA1HCCR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7939528-B2 | Heterocycle compounds | GLAXOSMITHKLINE LLC (US) | 2011-05-10 | — | — | US | disclosed |