Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.40 |
| ▸ | ALDH1A3 | P47895 | 4/20 | 0.36 |
| ▸ | ALDH1A2 | O94788 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.33 |
| ▸ | MAT2A | P31153 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5431789 | 0.96 | GRM1 (0.36) | MEN1KMT2AALDH1A3ALDH1A2ALDH1A1 | |
| SCHEMBL5438500 | 0.91 | MAOA (0.40) | MEN1KMT2AALDH1A3ALDH1A2ALDH1A1 | |
| SCHEMBL5446878 | 0.89 | BRD9 (0.39) | MEN1KMT2AALDH1A3ALDH1A2ALDH1A1 | |
| SCHEMBL5432024 | 0.88 | ALDH1A2 (0.34) | MEN1KMT2AALDH1A3ALDH1A2ALDH1A1 | |
| SCHEMBL5431688 | 0.86 | MEN1 (0.33) | MEN1KMT2AALDH1A3ALDH1A2ALDH1A1 | |
| SCHEMBL5431360 | 0.86 | MEN1 (0.35) | MEN1KMT2AALDH1A3ALDH1A2ALDH1A1 | |
| SCHEMBL5429219 | 0.86 | ALDH1A2 (0.40) | KMT2AALDH1A3ALDH1A2MAOAMAOB | |
| SCHEMBL5429779 | 0.85 | TP53 (0.39) | MEN1KMT2AALDH1A1NPSR1TP53 | |
| SCHEMBL5432062 | 0.85 | BRD9 (0.39) | MEN1KMT2AALDH1A3ALDH1A2ALDH1A1 | |
| SCHEMBL5427442 | 0.84 | CTSS (0.35) | MEN1KMT2AALDH1A3ALDH1A2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1687306-A1 | BICYCLIC PYRIMIDIN-4-(3H)-ONES AND ANALOGUES AND DERIVATIVES THEREOF WHICH MODULATE THE FUNCTION OF THE VANILLOID-1 RECEPTOR (VR1) | MERCK SHARP & DOHME LTD. (GB) | 2006-08-09 | — | — | EP | claimed |
| WO-2005049613-A1 | BICYCLIC PYRIMIDIN-4-(3H)-ONES AND ANALOGUES AND DERIVATIVES THEREOF WHICH MODULATE THE FUNCTION OF THE VANILLOID-1 RECEPTOR (VR1) | MERCK SHARP & DOHME LIMITED (GB) | 2005-06-02 | — | — | WO | claimed |