Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 6/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | ADK | P55263 | 1/20 | 0.33 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4778360 | 0.80 | TAAR1 (0.38) | TAAR1MTORADKNISCHHTR1A | |
| SCHEMBL4779370 | 0.79 | TAAR1 (0.35) | TAAR1MTORADKNISCHHTR1A | |
| SCHEMBL5357336 | 0.79 | TAAR1 (0.34) | TAAR1MTORADKNISCHALDH1A1 | |
| SCHEMBL16653081 | 0.74 | ALDH1A1 (0.46) | TAAR1MTORADKNISCHALDH1A1 | |
| SCHEMBL8612344 | 0.74 | TAAR1 (0.53) | TAAR1MTORADKNISCHALDH1A1 | |
| SCHEMBL21913077 | 0.70 | TAAR1 (0.44) | TAAR1MTORADKNISCHALDH1A1 | |
| SCHEMBL4776714 | 0.69 | TAAR1 (0.37) | TAAR1MTORADKNISCHALDH1A1 | |
| SCHEMBL4794835 | 0.68 | ADRA2A (0.42) | TAAR1NISCHALDH1A1 | |
| SCHEMBL27270344 | 0.68 | — | — | |
| SCHEMBL693664 | 0.67 | MEN1 (0.37) | ALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008009963-A2 | PYRIMIDINE DERIVATIVES AS MODULATORS OF PARATHYROID HORMONE RECEPTORS | JAMES BLACK FOUNDATION LIMITED (GB) | 2008-01-24 | — | — | WO | claimed |
| WO-2008009963-A2 | PYRIMIDINE DERIVATIVES AS MODULATORS OF PARATHYROID HORMONE RECEPTORS | JAMES BLACK FOUNDATION LIMITED (GB) | 2008-01-24 | — | — | WO | disclosed |
| WO-2006129120-A9 | BENZOTRIAZEPINONE DERIVATIVES | JAMES BLACK FOUNDATION (GB) | 2007-03-22 | — | — | WO | disclosed |
| WO-2006129120-A2 | BENZOTRIAZEPINONE DERIVATIVES | JAMES BLACK FOUNDATION (GB) | 2006-12-07 | — | — | WO | disclosed |