Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 6/20 | 0.42 |
| ▸ | CYP17A1 | P05093 | 6/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | THPO | P40225 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22694971 | 0.85 | HRH4 (0.40) | HRH4CYP17A1CYP3A4HRH3ALDH1A1 | |
| SCHEMBL14415970 | 0.76 | HRH4 (0.44) | HRH4HRH3ALDH1A1MEN1GLA | |
| Hydrochloric Acid SCHEMBL25371613 | 0.74 | HRH4 (0.43) | HRH4HRH3ALDH1A1MEN1GLA | |
| SCHEMBL14857108 | 0.74 | HRH4 (0.43) | HRH4CYP17A1CYP3A4HRH3ALDH1A1 | |
| SCHEMBL26052366 | 0.73 | HRH1 (0.42) | HRH4HRH3LMNAAPEX1 | |
| SCHEMBL26812529 | 0.73 | HRH4 (0.42) | HRH4CYP17A1CYP3A4HRH3ALDH1A1 | |
| SCHEMBL22082313 | 0.70 | CPB1 (0.41) | HRH4HRH3ALDH1A1MEN1GLA | |
| SCHEMBL14857315 | 0.69 | HRH3 (0.39) | HRH4CYP17A1CYP3A4HRH3ALDH1A1 | |
| SCHEMBL20696520 | 0.69 | HRH3 (0.44) | HRH4CYP3A4HRH3CYP1A2 | |
| SCHEMBL27617871 | 0.69 | — | — |
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-2741731-B1 | ENCAPSULATES | PROCTER & GAMBLE (US) | 2017-05-17 | — | — | EP | disclosed |
| WO-2014189906-A2 | ENCAPSULATES | THE PROCTER & GAMBLE COMPANY (US) | 2014-11-27 | — | — | WO | disclosed |