Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 15/20 | 0.60 |
| ▸ | PPARA | Q07869 | 2/20 | 0.53 |
| ▸ | PPARG | P37231 | 1/20 | 0.51 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.51 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.51 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.51 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.51 |
| ▸ | CTSS | P25774 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL13184604 | 0.89 | PPARA (0.65) | PPARAPPARGCTSS | |
| SCHEMBL19312176 | 0.89 | PPARA (0.65) | PPARAPPARGCTSS | |
| SCHEMBL8912564 | 0.86 | TACR1 (0.77) | TACR1PPARAPPARGCACNA1FCACNA1D | |
| SCHEMBL8458769 | 0.85 | TACR1 (0.64) | TACR1PPARACACNA1FCACNA1DCACNA1S | |
| SCHEMBL8936824 | 0.85 | TACR1 (0.64) | TACR1PPARACACNA1FCACNA1DCACNA1S | |
| SCHEMBL9279564 | 0.83 | ATM (0.58) | TACR1PPARAPPARGCTSS | |
| SCHEMBL9279559 | 0.83 | ATM (0.58) | TACR1PPARAPPARGCTSS | |
| SCHEMBL7757120 | 0.81 | CTSK (0.51) | PPARAPPARGCTSS | |
| SCHEMBL17846052 | 0.81 | CTSK (0.51) | PPARAPPARGCTSS | |
| SCHEMBL19348998 | 0.79 | CTSK (0.49) | PPARAPPARGCTSS |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5610183-A | Phenylglycine derivatives pharmaceutical compositions containing them and their use in therapy | MERCK, SHARP & DOHME LTD. (GB) | 1997-03-11 | — | — | US | disclosed |
| EP-0593615-B1 | AROMATIC COMPOUNDS, COMPOSITIONS CONTAINING THEM AND THEIR USE IN THERAPY | MERCK SHARP & DOHME (GB) | 1996-01-31 | — | — | EP | disclosed |
| EP-0593615-A1 | AROMATIC COMPOUNDS, COMPOSITIONS CONTAINING THEM AND THEIR USE IN THERAPY. | MERCK SHARP & DOHME (GB) | 1994-04-27 | — | — | EP | disclosed |
| WO-1993001165-A2 | AROMATIC COMPOUNDS, COMPOSITIONS CONTAINING THEM AND THEIR USE IN THERAPY | MERCK SHARP & DOHME LIMITED (GB) | 1993-01-21 | — | — | WO | disclosed |